data_2lqt_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 2lqt _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 121.319 0.581 . . . . 2.37 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 3.19 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 4.0 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 3.21 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.22 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 2.13 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.69 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 2.64 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 7.07 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.63 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 2.25 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.94 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.42 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 2.0 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 4.67 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 3.89 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.26 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 6.18 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.84 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 2.37 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 3.33 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 3.49 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 6.98 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 2.18 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 5.45 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 3.87 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 3.43 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 2.57 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 5.4 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 4.4 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 3.32 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.11 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.72 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 3.34 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 1.94 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 1.88 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 4.33 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.9 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 3.03 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.67 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 2.73 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.36 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.56 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 3.14 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 4.34 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.33 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 3.56 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 2.47 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.88 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 3.42 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 3.59 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 3.18 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.14 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 6.23 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.66 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.65 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.9 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 2.01 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 6.26 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 2.33 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 1.65 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.44 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.86 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.93 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 3.51 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 121.605 0.717 . . . . 1.28 111.869 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 4.29 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 3.29 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.4 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 2.13 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.57 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 2.04 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 2.03 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 2.09 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 7.01 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.53 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 2.05 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.42 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.55 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.88 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 3.5 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 4.61 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.26 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 5.84 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.91 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 4.5 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 3.02 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.95 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 3.73 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 7.59 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 2.54 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 5.41 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 3.63 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 5.6 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.41 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 2.29 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.95 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 6.59 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 3.17 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.13 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.85 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.88 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 1.93 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 1.87 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 2.94 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.57 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 3.23 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 3.37 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 3.41 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.81 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.53 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.98 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 3.47 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.79 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 3.99 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 2.02 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.07 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 2.21 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 2.53 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 2.72 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.62 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 4.59 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.38 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.58 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 1.97 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 2.12 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 5.66 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 1.97 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 1.83 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 3.36 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 2.04 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.35 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 3.59 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.59 0.709 . . . . 1.59 112.221 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 5.22 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 3.05 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.49 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 2.57 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.72 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.99 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 2.13 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 2.24 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 5.69 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.27 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.88 113.468 -178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.92 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.12 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.63 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 4.15 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 4.17 115.847 174.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 5.57 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.78 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 5.06 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 3.06 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.96 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 3.3 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 7.53 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 2.42 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 5.72 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 4.01 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 5.07 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.65 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.48 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 6.77 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 6.49 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 3.25 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.92 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.84 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 2.08 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 1.61 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 1.88 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 3.13 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.48 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 4.84 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 3.24 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 2.89 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.79 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 3.55 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 3.33 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 2.17 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 3.66 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 2.15 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.95 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 2.11 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 2.2 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 2.64 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 4.28 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.88 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 1.64 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 2.11 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 4.7 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 1.9 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 2.06 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 3.72 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 2.21 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.13 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 4.13 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.77 113.394 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 5.19 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.26 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.72 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.61 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.15 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.68 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.95 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 2.63 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 5.7 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.64 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.72 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.17 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.82 113.052 -173.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 7.24 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 5.26 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.19 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 7.05 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.44 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 5.53 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.06 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 2.37 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 3.35 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 3.5 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 6.65 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 2.15 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 5.62 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 3.34 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 4.29 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.42 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 2.7 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 4.61 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 5.56 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 3.86 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.2 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.56 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 2.02 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 1.94 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 1.88 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 2.71 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.41 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.98 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.83 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 3.61 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.08 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 4.13 114.708 -161.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 2.89 112.818 -179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.34 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 3.63 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 2.62 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 3.28 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.82 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 3.05 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.12 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 5.73 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.31 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.69 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 1.98 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 1.81 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 5.18 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 2.08 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 2.65 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.24 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 3.22 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 2.78 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.42 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 4.52 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.428 0.632 . . . . 1.28 112.115 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 3.62 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.87 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.8 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 2.67 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.94 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 1.72 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 2.55 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 2.27 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 7.34 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.15 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 2.41 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.85 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.14 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.6 112.416 -165.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 4.1 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 6.19 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 8.41 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.24 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 4.51 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.94 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 3.34 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.74 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 3.53 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 5.31 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 2.04 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 5.42 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 3.17 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 3.42 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.13 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.18 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 5.36 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 4.76 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 3.41 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.8 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.42 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 3.21 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 1.86 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 1.73 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 3.66 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 3.11 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 5.46 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 3.96 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 3.33 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 3.26 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 3.31 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.45 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 3.23 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 1.87 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.08 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 2.29 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 2.75 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 2.43 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 5.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.22 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.28 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 1.97 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.96 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.78 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 2.07 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 2.39 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 2.53 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.7 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.08 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 4.63 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 122.202 1.001 . . . . 1.7 113.169 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 3.91 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 3.27 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.31 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 2.59 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.59 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 2.48 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 2.02 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 2.55 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 6.42 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 2.04 113.046 -178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.51 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.68 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.84 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 5.11 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 3.98 115.553 -176.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.63 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 7.95 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 4.14 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.71 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.9 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 3.3 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 5.25 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 2.62 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 5.22 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 4.06 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 4.45 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.84 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.51 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.88 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 5.67 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 3.63 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.25 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 2.2 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 1.9 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 2.09 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 3.72 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 3.7 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.87 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 2.62 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.53 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 2.61 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 2.86 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.5 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 3.22 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 2.13 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.36 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 2.61 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 3.13 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 3.5 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.53 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 6.22 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.426 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.12 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 2.02 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.82 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.426 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 4.5 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 2.21 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 2.03 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 2.01 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 2.29 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.43 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 3.66 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 113.863 1.06 . . . . 1.8 113.863 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 4.12 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.77 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.84 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 2.32 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.57 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 2.36 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 2.72 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 3.96 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 5.55 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.25 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.66 112.13 -175.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.44 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.35 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.72 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.12 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 5.82 114.091 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 7.16 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.83 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 5.01 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.35 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 2.77 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 3.7 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 3.72 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 5.69 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 2.76 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 5.74 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 3.89 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 4.26 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.75 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 6.96 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 5.7 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 3.4 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.17 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.9 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 2.53 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 1.78 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 2.36 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 3.44 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.78 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 4.22 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.49 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 3.53 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.31 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.22 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 6.11 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 3.26 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.73 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 4.73 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 2.5 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.36 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 2.75 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 2.58 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 2.08 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 4.41 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.42 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.76 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 1.66 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 2.56 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.86 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 2.45 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 2.44 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.18 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.61 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 2.74 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.46 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 4.21 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.551 . . . . 1.31 111.001 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 3.46 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 3.28 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.47 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 2.43 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.31 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 1.63 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 2.31 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.99 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 5.33 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.06 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.82 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.91 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.64 114.315 -159.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.92 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 5.01 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.74 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 5.1 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 4.29 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.9 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.7 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 2.7 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 3.44 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 7.25 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 2.4 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 5.26 112.689 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 3.61 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.98 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.37 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 2.04 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 4.83 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.97 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 3.26 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.77 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.58 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 1.81 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 1.91 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 3.49 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 4.8 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 3.2 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 3.23 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.3 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.65 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 3.25 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 3.03 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.37 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 3.24 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 2.22 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.98 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.88 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 2.26 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 2.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.26 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 4.38 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.93 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.09 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 1.85 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 1.88 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 6.41 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 1.74 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 2.03 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.15 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 3.17 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.99 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 3.76 112.85 176.093 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.698 0.761 . . . . 2.18 112.891 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 3.32 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 3.01 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.44 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 3.12 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 2.7 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.81 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 3.13 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.64 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.62 112.813 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.13 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.84 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 5.02 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 6.74 113.933 -171.179 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 7.51 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.3 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 5.64 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.25 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 4.07 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 4.78 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 3.99 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 5.58 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 3.46 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 5.41 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 4.2 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 4.62 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.92 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.17 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 4.41 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 5.92 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 3.31 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.31 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.97 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.6 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 1.53 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 2.01 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 3.29 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.445 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.1 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 3.01 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 3.41 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 3.25 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.42 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.34 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 3.02 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 4.19 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.5 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 3.51 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 2.58 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.68 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 3.03 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 3.33 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 3.23 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.01 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 5.8 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.35 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.01 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.98 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 2.06 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 6.29 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 2.58 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.73 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.32 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 2.18 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.98 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.57 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 4.37 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.54 112.695 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 4.34 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 2.27 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.26 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 2.16 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.82 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.77 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.64 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 2.34 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 6.92 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.39 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 2.15 112.533 -176.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.13 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.88 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.73 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 5.4 114.678 -173.513 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.8 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 5.33 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.72 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 5.5 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.11 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.95 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.88 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 3.41 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 7.57 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.88 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 5.12 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 3.79 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 4.1 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.1 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.77 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 5.43 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 6.08 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 3.13 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.75 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.89 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.94 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 1.62 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 1.9 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 3.19 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.93 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 3.21 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 5.91 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 2.82 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.41 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.39 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 2.67 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 3.63 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.91 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 3.16 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 1.86 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.17 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 2.3 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 2.0 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 2.59 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.34 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 6.74 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.58 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.32 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.95 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 2.06 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 5.79 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.92 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.9 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.18 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 2.15 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.66 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.92 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 4.32 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.86 113.515 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 4.07 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 2.45 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.59 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 2.44 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.93 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.96 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.91 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 2.72 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 5.94 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.47 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.91 113.699 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.94 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.51 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.54 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 4.98 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 3.7 115.264 -172.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.3 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.91 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.26 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 5.65 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.06 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 3.1 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.8 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 3.66 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 5.39 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 2.41 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 6.55 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 4.36 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 4.14 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.43 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 2.75 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 9.45 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 5.29 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 3.71 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.99 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.82 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.94 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 2.2 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 2.04 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 3.66 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.85 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 5.06 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 4.43 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 3.98 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.53 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.9 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 3.52 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 3.58 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.82 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 4.27 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.97 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.86 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 2.15 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.94 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.19 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 4.28 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.4 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 2.2 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 1.83 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 5.64 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.95 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.89 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.62 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 2.1 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.57 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 4.44 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.8 111.687 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 5.52 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 4.57 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 3.19 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 2.39 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 2.91 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 2.46 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 2.33 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 6.83 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.84 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.57 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.97 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 4.13 116.239 178.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.18 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 6.79 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.36 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 5.8 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.9 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 3.08 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 4.1 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 7.35 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 2.73 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.85 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 4.11 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.97 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.88 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.48 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 8.29 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 4.7 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 3.46 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.23 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.47 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.97 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 2.03 110.693 173.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 2.45 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 3.28 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.71 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 4.33 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 4.39 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 4.53 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.88 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.03 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 4.52 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.9 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.75 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 4.34 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 2.25 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.93 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 2.31 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 3.91 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 3.47 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.51 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 5.86 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.09 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 2.15 111.14 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 3.04 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 8.79 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 2.26 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 2.37 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.05 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.44 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.45 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.89 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.81 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 2.11 112.204 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 3.5 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.31 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.95 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.94 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.56 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 2.0 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.89 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 2.73 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 6.61 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.96 112.917 -176.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.95 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.56 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.34 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 6.0 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 4.3 115.549 -179.244 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.78 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.22 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.79 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.98 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 2.38 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.74 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 3.46 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 6.48 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 2.6 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 6.48 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 3.66 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 3.41 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.19 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 5.27 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 5.27 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 3.61 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 1.05 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 2.19 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 1.88 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 2.05 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 3.45 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.72 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 3.56 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 4.43 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 3.7 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.91 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.07 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 3.26 113.771 -164.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 3.52 113.563 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.33 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 3.6 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 2.39 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.97 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.91 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 2.19 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.95 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.01 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.39 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 2.11 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 2.07 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 5.38 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 2.27 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 2.32 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.39 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 2.35 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.85 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.78 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 121.155 0.502 . . . . 1.97 111.384 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 3.04 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 2.66 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 3.04 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 2.02 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.53 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 2.3 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.97 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 2.54 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 6.83 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.2 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 2.24 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.84 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.83 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.44 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.87 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 5.35 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.55 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 7.98 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.37 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 4.68 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.85 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.64 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.6 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 3.39 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 5.95 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 2.08 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 6.5 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 4.09 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 4.85 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.19 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 2.54 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 5.5 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 5.7 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 3.73 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.85 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.78 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 1.62 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 1.76 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 3.46 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.38 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 3.14 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.84 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 2.47 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.12 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.87 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 3.4 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.85 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 3.65 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.98 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.96 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 2.22 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 2.56 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 2.55 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 5.87 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.47 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.53 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 1.71 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 1.62 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 5.72 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 1.96 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 2.1 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.96 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.88 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.07 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 3.35 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.439 0.638 . . . . 1.59 111.666 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 3.05 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 2.58 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.84 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.89 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.43 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 2.06 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 2.13 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 3.1 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 7.08 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.81 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.59 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.42 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.68 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.23 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 5.13 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 4.68 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 5.56 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.26 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 5.22 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 2.43 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 3.44 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 3.27 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 5.23 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 2.64 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 6.37 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 3.81 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 4.69 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 3.03 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 8.52 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 5.08 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 3.26 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.56 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 2.26 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 1.91 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 2.52 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 3.45 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 3.28 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 4.03 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 4.41 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 4.02 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 2.05 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 3.32 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 3.66 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.7 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.421 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 3.84 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 2.74 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.41 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 2.65 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 3.28 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 3.26 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 4.09 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.58 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 2.14 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 3.06 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 7.78 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 2.54 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 1.76 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.65 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.94 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 2.17 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.61 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 3.29 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.41 113.271 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 4.04 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.8 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.34 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 2.35 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.64 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.96 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 2.09 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 3.01 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 9.88 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.47 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 2.08 113.038 -173.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.13 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.79 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.54 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 4.21 114.782 179.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.65 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 6.0 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.91 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 6.82 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.59 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 2.81 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 4.31 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 4.31 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 7.49 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 2.82 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 7.12 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 3.62 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 4.12 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 2.13 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.98 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 5.15 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 3.41 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.96 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.93 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.87 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 2.21 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 1.82 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 3.3 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.57 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 5.03 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.91 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 3.06 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.61 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 3.0 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 3.67 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.71 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 3.6 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 2.0 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.93 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 2.52 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 2.1 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 4.4 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.8 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.26 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.88 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 2.13 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 7.66 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 2.15 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 2.1 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 2.27 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.86 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 3.93 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 121.651 0.738 . . . . 1.46 112.039 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 3.75 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.7 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.51 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 2.38 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.57 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 2.01 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 2.43 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 2.07 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 5.46 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.33 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.99 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.06 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.87 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.66 113.823 -161.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 4.82 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 4.33 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.28 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 6.17 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.55 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 6.22 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.09 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 3.38 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.76 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 3.44 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 7.3 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 2.13 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 7.88 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 3.31 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 4.24 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.07 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.94 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.91 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 4.57 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 3.25 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.94 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.61 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.91 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 1.74 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 1.75 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 4.05 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.16 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 3.58 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 4.13 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 3.04 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.54 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.41 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.83 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 3.42 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.97 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 3.38 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 2.02 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.9 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 2.04 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.9 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 2.15 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.69 109.39 173.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 5.54 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 1.82 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 2.01 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.9 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 2.02 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 1.84 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.12 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 2.24 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 2.24 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.35 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 4.15 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.727 0.64 . . . . 1.26 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 3.57 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.99 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 3.05 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 2.02 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.89 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 2.41 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 2.51 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 2.64 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.9 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.55 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 2.2 111.972 -177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.61 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.53 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.82 111.831 -161.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 4.06 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 4.36 115.359 174.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.41 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 6.69 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.87 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 8.17 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.65 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.49 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.7 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 4.1 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 5.35 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 2.41 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.81 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 3.25 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.78 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.97 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 4.9 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 5.91 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 3.17 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.79 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 4.38 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.95 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 1.76 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 1.59 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 5.39 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.92 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 4.29 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.62 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 2.92 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.94 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.44 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 3.14 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 3.84 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.79 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 3.78 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 2.02 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.14 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 2.47 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 2.46 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 2.19 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.99 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 4.43 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.55 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.39 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.8 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.93 111.923 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.9 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 2.48 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 2.09 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.58 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 2.22 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.93 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 4.24 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.813 0.339 . . . . 1.45 111.491 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 3.26 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.75 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.68 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 2.66 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 1.82 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.95 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 2.08 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 5.45 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 2.18 112.846 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.67 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.11 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 4.29 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 3.69 114.93 -177.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.4 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 6.71 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 8.11 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 2.59 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.61 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 4.38 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 5.2 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 2.1 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 5.59 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 3.41 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 5.4 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.12 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 2.17 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 8.34 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 6.02 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 3.43 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.98 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.87 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 2.27 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 1.72 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 1.8 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 3.21 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.83 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 5.05 112.821 163.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 3.06 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 3.09 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.44 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 3.15 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.95 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 2.0 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 3.09 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 2.27 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.14 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 2.2 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 2.06 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 2.43 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.31 108.669 176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 4.62 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 1.72 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 1.72 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 6.56 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 1.8 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 1.78 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.8 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 2.27 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 4.3 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.929 0.395 . . . . 1.29 111.669 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 3.64 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.99 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 2.22 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.65 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.88 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.89 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 2.03 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 7.79 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.23 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 2.1 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.3 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.6 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.54 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.89 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 5.09 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.34 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 6.99 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 4.68 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 2.45 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 3.48 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 3.35 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 6.51 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 2.01 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 5.53 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 3.45 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 5.51 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.22 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 2.06 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 5.09 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 5.45 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 3.51 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.83 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.46 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.75 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 1.88 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 1.76 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 3.09 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.77 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 5.42 112.64 167.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 4.0 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 2.76 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.31 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.43 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.41 HG12 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.95 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.41 ' H ' HG12 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.98 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.82 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 3.32 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 1.77 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 2.42 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 2.19 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 2.5 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.28 109.276 174.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 6.81 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.18 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.24 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 2.1 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 1.97 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 6.33 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 2.49 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 2.19 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.09 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 3.69 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 2.07 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.09 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 4.27 112.285 177.72 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 117.951 -1.024 . . . . 6.38 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.8 169.01 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.347 2.698 . . . . 2.68 113.203 -172.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 86.41 2.55 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.298 1.039 . . . . 2.37 111.213 174.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 3.19 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 4.0 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 3.21 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.22 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 2.13 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.69 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 2.64 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 7.07 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.63 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 2.25 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.94 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.42 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 2.0 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 4.67 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 3.89 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.26 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 6.18 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.84 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 2.37 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 3.33 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 3.49 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 6.98 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 2.18 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 5.45 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 3.87 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 3.43 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 2.57 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 5.4 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 4.4 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 3.32 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.11 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.72 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 3.34 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 1.94 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 1.88 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 4.33 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.9 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 3.03 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.67 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 2.73 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.36 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.56 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 3.14 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 4.34 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.33 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 3.56 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 2.47 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.88 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 3.42 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 3.59 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 3.18 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.14 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 6.23 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.66 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.65 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.9 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 2.01 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 6.26 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 2.33 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 1.65 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.44 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.86 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.93 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 3.51 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.231 -0.89 . . . . 3.51 109.682 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -82.61 158.62 16.58 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.388 2.725 . . . . 1.69 112.622 -178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m -97.54 68.35 2.13 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.122 -0.986 . . . . 1.28 111.869 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 4.29 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 3.29 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.4 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 2.13 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.57 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 2.04 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 2.03 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 2.09 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 7.01 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.53 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 2.05 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.42 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.55 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.88 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 3.5 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 4.61 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.26 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 5.84 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.91 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 4.5 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 3.02 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.95 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 3.73 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 7.59 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 2.54 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 5.41 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 3.63 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 5.6 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.41 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 2.29 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.95 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 6.59 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 3.17 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.13 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.85 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.88 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 1.93 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 1.87 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 2.94 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.57 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 3.23 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 3.37 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 3.41 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.81 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.53 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.98 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 3.47 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.79 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 3.99 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 2.02 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.07 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 2.21 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 2.53 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 2.72 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.62 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 4.59 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.38 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.58 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 1.97 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 2.12 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 5.66 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 1.97 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 1.83 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 3.36 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 2.04 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.35 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 3.59 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 . . . . . 0 N--CA 1.476 0.856 0 CA-C-O 117.95 -1.024 . . . . 4.54 109.693 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.82 128.07 8.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.131 2.554 . . . . 2.95 109.956 166.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m -99.15 84.45 3.04 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.041 -1.037 . . . . 1.59 112.221 -174.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 5.22 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 3.05 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.49 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 2.57 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.72 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.99 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 2.13 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 2.24 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 5.69 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.27 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.88 113.468 -178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.92 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.12 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.63 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 4.15 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 4.17 115.847 174.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 5.57 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.78 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 5.06 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 3.06 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.96 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 3.3 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 7.53 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 2.42 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 5.72 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 4.01 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 5.07 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.65 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.48 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 6.77 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 6.49 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 3.25 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.92 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.84 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 2.08 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 1.61 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 1.88 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 3.13 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.48 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 4.84 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 3.24 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 2.89 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.79 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 3.55 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 3.33 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 2.17 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 3.66 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 2.15 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.95 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 2.11 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 2.2 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 2.64 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 4.28 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.88 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 1.64 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 2.11 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 4.7 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 1.9 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 2.06 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 3.72 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 2.21 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.13 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 4.13 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 118.835 -0.602 . . . . 3.94 110.073 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -73.98 169.02 23.37 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.008 3.139 . . . . 3.08 111.329 170.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m -94.97 82.01 3.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.77 113.394 -177.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 5.19 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.26 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.72 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.61 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.15 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.68 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.95 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 2.63 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 5.7 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.64 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.72 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.17 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.82 113.052 -173.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 7.24 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 5.26 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.19 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 7.05 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.44 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 5.53 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.06 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 2.37 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 3.35 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 3.5 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 6.65 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 2.15 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 5.62 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 3.34 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 4.29 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.42 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 2.7 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 4.61 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 5.56 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 3.86 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.2 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.56 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 2.02 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 1.94 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 1.88 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 2.71 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.41 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.98 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.83 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 3.61 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.08 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 4.13 114.708 -161.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 2.89 112.818 -179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.34 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 3.63 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 2.62 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 3.28 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.82 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 3.05 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.12 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 5.73 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.31 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.69 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 1.98 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 1.81 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 5.18 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 2.08 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 2.65 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.24 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 3.22 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 2.78 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.42 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 4.52 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 118.433 -0.794 . . . . 4.0 109.526 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -63.62 156.66 55.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 121.559 1.506 . . . . 1.79 109.935 150.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -119.4 103.52 9.54 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.602 0.761 . . . . 1.28 112.115 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 3.62 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.87 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.8 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 2.67 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.94 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 1.72 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 2.55 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 2.27 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 7.34 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.15 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 2.41 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.85 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.14 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.6 112.416 -165.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 4.1 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 6.19 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 8.41 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.24 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 4.51 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.94 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 3.34 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.74 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 3.53 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 5.31 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 2.04 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 5.42 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 3.17 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 3.42 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.13 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.18 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 5.36 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 4.76 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 3.41 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.8 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.42 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 3.21 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 1.86 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 1.73 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 3.66 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 3.11 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 5.46 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 3.96 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 3.33 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 3.26 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 3.31 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.45 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 3.23 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 1.87 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.08 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 2.29 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 2.75 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 2.43 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 5.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.22 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.28 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 1.97 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.96 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.78 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 2.07 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 2.39 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 2.53 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.7 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.08 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 4.63 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 118.953 -0.546 . . . . 4.46 111.31 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -64.43 148.2 90.7 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.238 3.292 . . . . 2.24 112.817 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m -90.17 64.16 6.03 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.337 1.055 . . . . 1.7 113.169 -170.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 3.91 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 3.27 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.31 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 2.59 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.59 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 2.48 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 2.02 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 2.55 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 6.42 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 2.04 113.046 -178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.51 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.68 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.84 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 5.11 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 3.98 115.553 -176.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.63 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 7.95 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 4.14 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.71 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.9 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 3.3 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 5.25 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 2.62 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 5.22 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 4.06 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 4.45 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.84 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.51 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.88 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 5.67 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 3.63 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.25 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 2.2 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 1.9 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 2.09 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 3.72 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 3.7 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.87 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 2.62 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.53 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 2.61 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 2.86 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.5 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 3.22 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 2.13 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.36 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 2.61 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 3.13 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 3.5 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.53 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 6.22 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.426 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.12 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 2.02 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.82 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.426 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 4.5 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 2.21 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 2.03 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 2.01 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 2.29 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.43 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 3.66 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 118.019 -0.991 . . . . 3.59 109.352 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -57.64 147.57 78.87 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.963 1.776 . . . . 2.07 111.341 161.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.49 77.66 1.06 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.85 1.26 . . . . 1.8 113.863 -165.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 4.12 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.77 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.84 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 2.32 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.57 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 2.36 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 2.72 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 3.96 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 5.55 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.25 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.66 112.13 -175.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.44 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.35 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.72 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.12 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 5.82 114.091 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 7.16 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.83 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 5.01 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.35 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 2.77 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 3.7 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 3.72 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.462 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 5.69 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 2.76 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 5.74 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 3.89 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 4.26 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.75 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 6.96 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 5.7 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 3.4 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.17 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.9 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 2.53 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 1.78 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 2.36 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 3.44 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.78 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 4.22 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.49 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 3.53 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.31 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.22 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 6.11 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 3.26 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.73 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 4.73 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 2.5 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.36 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 2.75 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 2.58 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 2.08 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 4.41 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.42 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.76 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 1.66 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 2.56 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.86 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 2.45 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 2.44 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.18 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.61 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 2.74 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.46 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 4.21 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.657 -0.687 . . . . 3.91 110.783 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -69.4 173.71 10.25 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.073 3.182 . . . . 2.06 112.893 162.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m -122.83 88.52 2.94 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.792 1.237 . . . . 1.31 111.001 170.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 3.46 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 3.28 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.47 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 2.43 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.31 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 1.63 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 2.31 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.99 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 5.33 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.06 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.82 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.91 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.64 114.315 -159.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.92 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 5.01 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.74 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 5.1 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 4.29 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.9 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.7 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 2.7 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 3.44 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 7.25 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 2.4 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 5.26 112.689 178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 3.61 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.98 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.37 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 2.04 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 4.83 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.97 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 3.26 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.77 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.58 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 1.81 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 1.91 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 3.49 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 4.8 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 3.2 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 3.23 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.3 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.65 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 3.25 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 3.03 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.37 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 3.24 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 2.22 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.98 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.88 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 2.26 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 2.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.26 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 4.38 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.93 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.09 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 1.85 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 1.88 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 6.41 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 1.74 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 2.03 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.15 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 3.17 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.99 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 3.76 112.85 176.093 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.611 -0.709 . . . . 3.88 110.98 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.04 151.16 86.7 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.234 2.623 . . . . 1.86 111.005 165.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 69.48 2.67 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.348 -0.845 . . . . 2.18 112.891 -169.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 3.32 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 3.01 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.44 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 3.12 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 2.7 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.81 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 3.13 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.64 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.62 112.813 -177.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.13 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.84 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 5.02 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 6.74 113.933 -171.179 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 7.51 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.3 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 5.64 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.25 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 4.07 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 4.78 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 3.99 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 5.58 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 3.46 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 5.41 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 4.2 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 4.62 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.92 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.17 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 4.41 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 5.92 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 3.31 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.31 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.97 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.6 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 1.53 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 2.01 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 3.29 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.445 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.1 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 3.01 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 3.41 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 3.25 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.42 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.34 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 3.02 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 4.19 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.5 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 3.51 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 2.58 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.68 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 3.03 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 3.33 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 3.23 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.01 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 5.8 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.35 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.01 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.98 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 2.06 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 6.29 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 2.58 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.73 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.32 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 2.18 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.98 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.57 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 4.37 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 118.214 -0.898 . . . . 4.21 110.385 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -69.67 170.37 16.63 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.574 2.849 . . . . 1.92 113.468 167.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -110.24 77.93 1.09 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.54 112.695 -173.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 4.34 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 2.27 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.26 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 2.16 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.82 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.77 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.64 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 2.34 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 6.92 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.39 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 2.15 112.533 -176.51 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.13 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.88 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.73 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 5.4 114.678 -173.513 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.8 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 5.33 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.72 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 5.5 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.11 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.95 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.88 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 3.41 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 7.57 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.88 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 5.12 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 3.79 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 4.1 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.1 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.77 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 5.43 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 6.08 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 3.13 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.75 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.89 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.94 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 1.62 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 1.9 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 3.19 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.93 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 3.21 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 5.91 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 2.82 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.41 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.39 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 2.67 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 3.63 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.91 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 3.16 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 1.86 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.17 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 2.3 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 2.0 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 2.59 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.34 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 6.74 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.58 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.32 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.95 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 2.06 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 5.79 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.92 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.9 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.18 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 2.15 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.66 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.92 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 4.32 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.323 -0.846 . . . . 4.16 109.533 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -81.57 147.92 15.86 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.756 2.971 . . . . 2.87 111.732 170.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m -87.27 72.57 9.84 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.86 113.515 -170.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 4.07 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 2.45 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.59 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 2.44 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.93 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.96 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.91 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 2.72 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 5.94 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.47 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.91 113.699 -178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.94 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.51 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.54 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 4.98 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 3.7 115.264 -172.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.3 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.91 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.26 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 5.65 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.06 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 3.1 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.8 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 3.66 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 5.39 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 2.41 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 6.55 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 4.36 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 4.14 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.43 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 2.75 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 9.45 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 5.29 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 3.71 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.99 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.82 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.94 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 2.2 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 2.04 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 3.66 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.85 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 5.06 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 4.43 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 3.98 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.53 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.9 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 3.52 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 3.58 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.82 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 4.27 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.97 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.86 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 2.15 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.94 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.19 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 4.28 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.4 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 2.2 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 1.83 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 5.64 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.95 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.89 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.62 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 2.1 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.57 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 4.44 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.3 m120 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 118.771 -0.633 . . . . 5.03 110.078 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.51 157.94 59.44 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.122 2.548 . . . . 3.46 111.646 168.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -95.86 85.14 4.01 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.8 111.687 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 5.52 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 4.57 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 3.19 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 2.39 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 2.91 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 2.46 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 2.33 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 6.83 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.84 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.57 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.97 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 4.13 116.239 178.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.18 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 6.79 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.36 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 5.8 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.9 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 3.08 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 4.1 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 7.35 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 2.73 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.85 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 4.11 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.97 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.88 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.48 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 8.29 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 4.7 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 3.46 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.23 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.47 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.97 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 2.03 110.693 173.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 2.45 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 3.28 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.71 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 4.33 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 4.39 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 4.53 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.88 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.03 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 4.52 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.9 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.75 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 4.34 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 2.25 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.93 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 2.31 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 3.91 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 3.47 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.51 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 5.86 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.09 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 2.15 111.14 175.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 3.04 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 8.79 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 2.26 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 2.37 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.05 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.44 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.45 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.89 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.81 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 118.732 -0.651 . . . . 3.4 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -53.14 121.47 9.45 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 108.334 -1.449 . . . . 2.37 108.334 153.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.79 62.79 2.32 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 2.11 112.204 -156.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 3.5 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.31 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.95 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.94 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.56 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 2.0 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.89 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 2.73 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 6.61 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.96 112.917 -176.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.95 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.56 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.34 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 6.0 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 4.3 115.549 -179.244 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.78 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.22 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.79 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.98 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 2.38 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.74 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 3.46 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 6.48 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 2.6 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 6.48 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 3.66 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 3.41 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.19 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 5.27 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 5.27 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 3.61 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 1.05 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 2.19 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 1.88 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 2.05 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 3.45 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.72 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 3.56 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 4.43 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 3.7 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.91 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.07 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 3.26 113.771 -164.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 3.52 113.563 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.33 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 3.6 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 2.39 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.97 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.91 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 2.19 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.95 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.01 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.39 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 2.11 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 2.07 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 5.38 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 2.27 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 2.32 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.39 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 2.35 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.85 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.78 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 118.951 -0.547 . . . . 6.9 110.451 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.13 168.77 16.64 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.481 2.787 . . . . 3.9 112.707 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.34 73.4 10.48 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.009 -1.057 . . . . 1.97 111.384 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 3.04 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 2.66 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 3.04 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 2.02 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.53 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 2.3 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.97 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 2.54 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 6.83 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.2 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 2.24 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.84 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.83 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.44 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.87 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 5.35 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.55 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 7.98 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.37 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 4.68 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.85 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.64 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.6 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 3.39 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 5.95 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 2.08 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 6.5 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 4.09 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 4.85 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.19 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 2.54 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 5.5 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 5.7 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 3.73 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.85 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.78 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 1.62 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 1.76 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 3.46 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.38 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 3.14 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.84 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 2.47 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.12 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.87 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 3.4 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.85 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 3.65 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.98 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.96 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 2.22 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 2.56 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 2.55 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 5.87 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.47 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.53 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 1.71 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 1.62 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 5.72 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 1.96 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 2.1 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.96 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.88 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.07 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 3.35 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.442 -0.577 . . . . 3.31 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -59.55 141.35 97.13 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.273 1.315 . . . . 1.69 110.059 151.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.12 80.72 5.63 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.479 -0.763 . . . . 1.59 111.666 -176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 3.05 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 2.58 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.84 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.89 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.43 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 2.06 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 2.13 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 3.1 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 7.08 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.81 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.59 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.42 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.68 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.23 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 5.13 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 4.68 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 5.56 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.26 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 5.22 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 2.43 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 3.44 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 3.27 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 5.23 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 2.64 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 6.37 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 3.81 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 4.69 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 3.03 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 8.52 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 5.08 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 3.26 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.56 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 2.26 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 1.91 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 2.52 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 3.45 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 3.28 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.421 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 4.03 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 4.41 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 4.02 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 2.05 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 3.32 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 3.66 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.7 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.421 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 3.84 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 2.74 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.41 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 2.65 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 3.28 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 3.26 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 4.09 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.58 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 2.14 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 3.06 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 7.78 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 2.54 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 1.76 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.65 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.94 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 2.17 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.61 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 3.29 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 118.982 -0.533 . . . . 3.78 110.239 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -59.78 164.86 10.94 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.843 2.362 . . . . 1.87 111.198 152.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.33 84.42 1.97 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.41 113.271 -169.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 4.04 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.8 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.34 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 2.35 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.64 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.96 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 2.09 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 3.01 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 9.88 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.47 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 2.08 113.038 -173.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.13 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.79 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.54 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 4.21 114.782 179.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.65 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 6.0 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.91 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 6.82 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.59 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 2.81 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 4.31 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 4.31 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 7.49 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 2.82 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 7.12 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 3.62 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 4.12 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 2.13 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.98 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 5.15 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 3.41 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.96 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.93 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.87 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 2.21 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 1.82 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 3.3 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.57 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 5.03 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.91 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 3.06 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.61 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 3.0 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 3.67 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.71 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 3.6 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 2.0 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.93 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 2.52 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 2.1 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 4.4 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.8 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.26 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.88 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 2.13 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 7.66 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 2.15 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 2.1 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 2.27 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.86 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 3.93 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 118.76 -0.638 . . . . 3.38 109.433 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -56.39 132.22 50.52 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 N-CA-C 108.564 -1.36 . . . . 2.34 108.564 152.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m -80.97 79.86 7.56 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.461 -0.774 . . . . 1.46 112.039 -174.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 3.75 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.7 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.51 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 2.38 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.57 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 2.01 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 2.43 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 2.07 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 5.46 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.33 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.99 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.06 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.87 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.66 113.823 -161.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 4.82 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 4.33 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.28 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 6.17 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.55 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 6.22 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.09 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 3.38 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.76 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 3.44 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 7.3 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 2.13 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 7.88 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 3.31 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 4.24 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.07 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.94 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.91 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 4.57 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 3.25 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.94 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.61 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.91 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 1.74 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 1.75 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 4.05 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.16 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 3.58 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 4.13 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 3.04 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.54 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.41 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.83 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 3.42 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.97 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 3.38 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 2.02 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.9 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 2.04 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.9 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 2.15 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.69 109.39 173.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 5.54 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 1.82 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 2.01 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.9 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 2.02 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 1.84 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.12 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 2.24 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 2.24 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.35 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 4.15 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 118.806 -0.616 . . . . 3.96 109.958 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -63.91 138.37 62.59 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 122.145 1.897 . . . . 1.89 109.801 168.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -91.39 58.37 3.59 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.454 -0.778 . . . . 1.26 112.727 -164.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 3.57 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.99 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 3.05 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 2.02 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.89 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 2.41 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 2.51 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 2.64 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.9 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.55 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 2.2 111.972 -177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.61 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.53 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.82 111.831 -161.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 4.06 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 4.36 115.359 174.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.41 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 6.69 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.87 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 8.17 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.65 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.49 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.7 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 4.1 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.481 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 5.35 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 2.41 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.81 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 3.25 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.78 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.97 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 4.9 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 5.91 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 3.17 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.79 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 4.38 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.95 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 1.76 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 1.59 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 5.39 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.92 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 4.29 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.62 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 2.92 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.94 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.44 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 3.14 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 3.84 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.79 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 3.78 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 2.02 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.14 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 2.47 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 2.46 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 2.19 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.99 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 4.43 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.55 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.39 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.8 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.93 111.923 170.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.9 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 2.48 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 2.09 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.58 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 2.22 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.93 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 4.24 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.614 -0.708 . . . . 4.76 110.083 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -76.86 170.71 19.31 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.576 2.851 . . . . 1.59 110.9 164.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m -106.23 87.97 2.68 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.904 0.881 . . . . 1.45 111.491 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 3.26 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.75 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.68 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 2.66 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 1.82 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.95 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 2.08 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 5.45 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 2.18 112.846 -178.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.67 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.11 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 4.29 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 3.69 114.93 -177.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.4 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 6.71 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 8.11 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 2.59 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.61 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 4.38 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 5.2 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 2.1 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 5.59 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 3.41 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 5.4 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.12 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 2.17 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 8.34 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 6.02 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 3.43 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.98 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.87 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 2.27 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 1.72 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 1.8 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 3.21 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.83 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 5.05 112.821 163.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 3.06 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 3.09 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.44 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 3.15 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.95 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 2.0 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 3.09 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 2.27 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.14 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 2.2 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 2.06 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 2.43 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.31 108.669 176.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 4.62 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 1.72 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 1.72 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 6.56 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 1.8 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 1.78 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.8 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 2.27 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 4.3 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 119.396 -0.335 . . . . 4.64 111.648 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -71.33 166.33 29.62 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.908 2.405 . . . . 1.82 110.982 151.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -113.38 77.27 1.04 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.191 0.996 . . . . 1.29 111.669 175.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 3.64 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.99 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 2.22 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.65 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.88 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.89 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 2.03 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 7.79 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.23 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 2.1 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.3 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.6 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.54 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.89 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 5.09 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.34 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 6.99 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 4.68 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 2.45 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 3.48 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 3.35 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 6.51 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 2.01 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 5.53 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 3.45 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 5.51 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.22 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 2.06 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 5.09 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 5.45 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 3.51 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.83 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.46 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.75 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 1.88 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 1.76 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 3.09 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.77 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 5.42 112.64 167.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 4.0 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 2.76 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.31 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.43 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.41 HG12 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.95 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.41 ' H ' HG12 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.98 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.82 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 3.32 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 1.77 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 2.42 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 2.19 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 2.5 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.28 109.276 174.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 6.81 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.18 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.24 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 2.1 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 1.97 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 6.33 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 2.49 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 2.19 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.09 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 3.69 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 2.07 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.09 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 4.27 112.285 177.72 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 121.319 0.581 . . . . 1.98 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 2.52 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 3.38 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 2.63 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.22 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 1.45 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.12 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 1.55 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 5.86 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.62 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 1.59 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.94 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.42 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 1.98 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 3.95 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 2.8 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.26 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 5.23 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.12 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 1.85 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 2.43 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 2.11 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 5.55 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 1.26 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 4.59 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 2.65 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 2.76 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 1.99 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 4.6 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 3.64 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 2.04 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.02 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.57 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 2.56 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 0.51 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 0.71 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 3.21 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.41 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 2.36 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.03 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 1.87 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.36 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.56 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 2.33 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 3.29 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.09 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 2.21 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 1.58 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.88 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 2.35 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 2.48 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 2.4 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.14 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 5.47 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.66 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.65 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.11 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 1.35 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 5.32 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 1.11 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 0.88 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.44 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.3 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.46 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 2.4 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 121.605 0.717 . . . . 1.24 111.869 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 3.31 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 2.56 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.4 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 1.65 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.57 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 1.33 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 1.51 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 1.36 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 5.76 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.51 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 1.76 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.42 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.55 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.76 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 2.88 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 3.28 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.26 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 4.98 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.91 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 3.69 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 2.37 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.03 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 2.34 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 6.1 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 1.35 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 4.46 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 2.43 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 4.67 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.34 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 1.7 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.16 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 5.62 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 1.89 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.02 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.5 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.36 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 0.58 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 0.74 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 1.83 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.4 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 2.63 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 2.85 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 2.42 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.46 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.5 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.1 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 2.61 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.54 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 2.6 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 1.07 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.07 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 1.38 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 1.74 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 1.67 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.62 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 3.73 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.38 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.58 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 0.97 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 1.08 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 4.62 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 0.98 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 0.95 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 2.61 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 1.66 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.35 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 2.48 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.59 0.709 . . . . 1.59 112.221 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 3.85 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 2.19 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.49 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 1.55 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.72 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.06 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 1.67 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 1.41 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 4.61 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.26 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.43 113.468 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.92 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.12 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.49 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 3.22 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.419 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 3.05 115.847 174.36 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 4.87 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.78 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 4.28 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 2.36 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.29 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 2.07 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 6.08 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 1.28 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 4.65 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 2.76 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 3.9 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.65 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.29 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 5.7 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 5.39 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 1.96 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.82 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.3 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 1.4 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 0.6 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 0.87 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 2.04 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.05 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 3.83 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 2.69 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 1.95 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.57 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 2.53 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 2.32 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 1.98 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 2.44 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 1.15 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.95 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 1.11 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 1.39 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 1.52 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 3.6 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.88 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 0.72 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 0.91 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 3.94 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 0.99 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 0.85 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 2.42 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 1.48 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.13 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 2.93 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.67 113.394 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 3.92 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.26 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.72 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.24 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.15 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.07 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.32 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 1.66 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 4.88 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.64 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.72 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.17 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.82 113.052 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 6.25 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 4.08 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.19 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 6.57 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.44 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 4.6 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.06 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 1.89 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 2.36 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 2.12 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 5.22 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 1.26 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 4.74 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 2.17 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 3.31 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.42 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 1.66 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 3.75 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 4.75 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 2.42 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.1 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.14 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 1.38 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 0.82 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 0.86 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 1.9 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.41 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.38 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.41 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 2.75 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.08 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 64' ' ' LYS . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 3.24 114.708 -161.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.438 ' H ' HG13 ' A' ' 63' ' ' VAL . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 1.88 112.818 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.11 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 2.29 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 1.45 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 2.17 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.08 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 2.18 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.12 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 4.62 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.31 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.69 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 0.94 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 0.92 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 4.47 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 1.43 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 1.43 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.23 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 2.69 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 1.85 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.42 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 3.07 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.428 0.632 . . . . 1.14 112.115 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 2.52 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.03 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.73 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 1.7 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.94 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 0.98 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 1.74 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 1.29 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 6.08 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.1 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 1.41 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.85 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.14 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.57 112.416 -165.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 3.33 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 5.54 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 7.2 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.24 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 3.68 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.94 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 2.2 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.29 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 2.15 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 4.24 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 1.16 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 4.62 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 1.99 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 2.61 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.13 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.08 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 4.47 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 3.95 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 2.02 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.69 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.42 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 2.55 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 0.56 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 0.6 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 2.43 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 2.44 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 4.86 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 2.84 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 2.9 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 2.33 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 2.38 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.31 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 1.98 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 0.98 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.08 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 1.38 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 1.49 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 1.58 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 4.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.22 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.28 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 0.83 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.01 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.19 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 1.33 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 1.14 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 1.82 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.35 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.08 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 3.11 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 122.202 1.001 . . . . 1.5 113.169 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 2.96 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 2.25 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.31 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 1.88 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.59 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 1.25 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 1.51 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 1.58 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 5.39 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 1.69 113.046 -178.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.51 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.68 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.84 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 4.2 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.424 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 2.86 115.553 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.63 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 6.58 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 3.65 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.07 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.1 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 2.04 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 4.02 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 1.63 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 4.46 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 2.76 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 3.52 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.84 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.19 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.19 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 4.84 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 2.18 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.08 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 1.56 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 0.52 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 0.69 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 2.68 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 2.89 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.53 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 1.79 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.35 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 1.87 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 1.9 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.36 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 1.98 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 1.12 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.36 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 1.93 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 2.23 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 2.34 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.53 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 4.99 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.429 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.12 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 1.14 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.03 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 3.79 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 1.15 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 0.95 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 1.8 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 1.38 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.43 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 2.56 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 113.863 1.06 . . . . 1.79 113.863 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 3.2 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.29 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.84 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 1.61 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.57 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 1.64 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 1.62 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 2.87 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 4.73 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.15 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.66 112.13 -175.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.44 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.35 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.52 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.12 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.505 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 4.47 114.091 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 6.46 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.83 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 4.0 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.31 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 1.75 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 2.62 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 2.45 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.464 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 4.64 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 1.63 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 4.91 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 2.7 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 3.38 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.52 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 5.97 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 4.98 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 2.13 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.05 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.7 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 1.38 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 0.58 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 1.14 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 2.3 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.62 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 3.6 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.08 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 2.59 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.29 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.22 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 4.65 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 2.52 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.45 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 3.38 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 1.69 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.36 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 1.92 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 1.6 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 1.44 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 3.51 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.42 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.76 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 0.97 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 1.31 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.15 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 1.44 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 1.79 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.18 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.61 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 1.86 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.45 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 3.05 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.551 . . . . 1.12 111.001 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 2.28 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 2.32 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.47 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 1.68 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.31 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 0.89 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 1.46 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.19 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 4.48 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.06 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.33 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.91 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.64 114.315 -159.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.09 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 3.72 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.74 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 4.46 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 3.45 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.9 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.13 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 1.95 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 2.07 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 5.81 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 1.38 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 ' C ' ' A' ' 85' ' ' TYR . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 4.48 112.689 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 2.26 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.08 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.23 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 1.48 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 3.93 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.26 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 1.99 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.72 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.01 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 0.47 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 0.61 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 2.3 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 3.8 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 2.79 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 2.19 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.3 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.65 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 2.27 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 2.15 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.14 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 2.0 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 1.15 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.98 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.15 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 1.27 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 1.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.26 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 3.58 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.93 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.09 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 0.75 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 0.82 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 5.41 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 0.92 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 0.97 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.15 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 2.73 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.1 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TYR . . . . . 0.405 ' C ' HH21 ' A' ' 43' ' ' ARG . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 2.52 112.85 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.698 0.761 . . . . 1.79 112.891 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 2.67 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 2.09 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.44 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 2.3 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 1.88 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.3 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 2.2 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.13 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.09 112.813 -177.871 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.13 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.84 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 4.11 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.599 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 5.4 113.933 -171.179 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 6.63 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.3 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 4.84 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.17 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 3.07 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 3.66 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 2.63 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 4.5 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 2.19 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 4.44 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 2.83 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 3.71 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.82 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.15 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 3.64 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 4.71 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 1.99 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.16 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.97 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.28 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 0.58 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 0.88 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 2.12 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.431 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.03 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 2.35 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 2.92 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 1.98 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.12 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.34 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 2.2 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 3.09 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.19 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 2.17 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 1.76 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.68 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 1.96 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 2.2 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 2.16 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.01 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 4.83 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.35 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.01 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.32 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 1.31 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 5.42 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 1.61 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.11 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.2 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 1.66 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.61 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.57 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 3.12 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.36 112.695 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 3.12 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 1.88 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.26 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 1.79 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.82 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.07 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.17 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 1.51 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 5.6 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.32 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 1.38 112.533 -176.51 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.13 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.64 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.01 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 4.01 114.678 -173.513 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.8 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 4.7 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.72 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 4.63 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.11 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.3 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.24 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 2.16 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 6.13 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.0 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 4.37 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 2.4 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 2.92 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.04 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.63 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 4.56 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 4.98 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 1.86 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.69 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.62 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.33 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 0.53 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 0.64 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 2.12 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.48 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 2.53 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 4.76 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 1.92 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.11 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.39 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 1.87 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 2.52 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.72 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 1.95 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 0.98 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.17 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 1.36 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 1.3 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 1.59 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.34 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 5.77 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.58 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.32 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.02 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 1.09 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 4.9 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.09 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.05 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.18 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 1.84 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.17 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.92 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 3.33 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.53 113.515 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 3.21 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 1.91 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.19 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 1.78 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.93 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.3 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.36 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 1.89 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 4.92 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.36 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 32' ' ' TYR . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.36 113.699 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.94 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.51 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.51 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 3.87 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.52 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 2.68 115.264 -172.268 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.3 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.28 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.26 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 4.94 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.06 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 2.57 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.36 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 2.37 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 4.34 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 1.3 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 5.75 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 2.94 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 3.07 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.39 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 1.78 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 7.9 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 4.43 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 2.28 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.85 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.82 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.22 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 0.84 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 0.96 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 2.69 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.56 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 4.39 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 3.83 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 2.71 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.29 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.9 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 2.56 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 2.41 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.53 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 3.1 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.33 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.15 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 1.31 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.32 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.19 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 3.74 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.4 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 1.04 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 0.94 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 4.7 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.05 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.14 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.62 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 1.57 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.57 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 3.01 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.6 111.687 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 4.57 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 3.72 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 2.39 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 1.83 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 1.7 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 1.62 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 1.57 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 5.87 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 32' ' ' TYR . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.84 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.43 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.03 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.405 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 3.14 116.239 178.84 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.18 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 5.93 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.36 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 4.94 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.22 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 2.79 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 2.86 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 5.89 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 1.5 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.08 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 2.91 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.03 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.88 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.45 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 6.86 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 3.53 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 2.11 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.1 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.47 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.42 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 76' ' ' ILE . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 0.66 110.693 173.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 1.19 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 2.13 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.66 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 3.54 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 3.74 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 3.5 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.4 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.03 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 3.44 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.02 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.59 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 2.96 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 1.31 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.9 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 1.74 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 2.47 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 2.87 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.51 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 4.66 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.09 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.438 HD13 HG21 ' A' ' 54' ' ' ILE . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 1.56 111.14 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 1.8 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 7.62 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 1.73 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 1.85 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.05 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.44 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.02 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.89 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.81 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 1.83 112.204 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 2.65 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.06 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.27 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.36 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.56 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 1.05 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.35 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 1.56 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 5.51 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.82 112.917 -176.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.95 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.56 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.11 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 4.99 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.512 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 3.23 115.549 -179.244 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.01 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.22 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.12 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.98 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 1.87 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.21 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 2.22 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 5.09 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 1.32 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 5.33 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 2.35 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 2.6 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.19 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 4.25 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 4.51 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 2.17 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 0.93 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 1.45 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 0.59 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 0.84 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 2.69 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.4 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 2.75 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 3.75 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 2.66 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.58 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.07 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.514 HG13 ' H ' ' A' ' 64' ' ' LYS . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 2.43 113.771 -164.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.514 ' H ' HG13 ' A' ' 63' ' ' VAL . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 2.64 113.563 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.1 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 2.39 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 1.51 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.08 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.25 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 1.32 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.05 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.01 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.39 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 0.88 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 1.15 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 4.68 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 1.59 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 1.53 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.39 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 1.73 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.85 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.04 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 121.155 0.502 . . . . 1.44 111.384 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 2.17 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 1.94 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 2.74 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 1.62 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.53 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 1.06 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.39 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 1.53 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 5.62 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.16 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 1.33 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.84 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.83 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.44 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.1 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 4.39 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.55 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 6.7 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.37 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 3.82 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.85 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.21 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.18 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 2.13 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 4.57 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 1.14 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 5.7 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 2.63 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 3.85 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.09 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 1.62 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 4.8 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 4.73 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 2.29 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.74 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.23 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 0.47 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 0.7 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 2.35 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.38 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 2.43 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.44 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 1.7 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.03 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.05 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 2.26 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.66 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 2.29 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.07 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.96 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 1.15 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 1.57 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 1.58 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 4.96 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.47 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.53 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.86 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 0.85 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 4.86 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 0.98 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 0.97 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.88 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.28 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.07 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 2.24 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.439 0.638 . . . . 1.49 111.666 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 2.15 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 1.79 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.84 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.48 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.43 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 1.46 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 1.58 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 2.12 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 6.41 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.76 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.32 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.42 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.67 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.1 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 4.24 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 3.57 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 4.79 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.26 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 4.24 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 1.71 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 2.85 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 2.1 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 4.17 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 1.52 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 5.49 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 2.5 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 3.69 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 1.88 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 7.0 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 4.22 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 2.01 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.39 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 1.62 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 0.59 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 1.17 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 2.28 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 2.56 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.411 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 3.64 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 3.47 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 3.88 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 1.94 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 2.37 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 2.5 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.58 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 2.59 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 1.9 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.41 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 1.66 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 2.37 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 2.48 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 3.44 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.58 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 1.37 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 1.6 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 6.74 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 1.43 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 0.96 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.55 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.94 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 1.74 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.61 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 2.51 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.29 113.271 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 2.96 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.09 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.34 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 1.82 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.64 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.17 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 1.58 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 1.94 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 8.43 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.32 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.56 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 1.4 113.038 -173.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.13 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.72 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.09 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.56 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 3.1 114.782 179.03 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.65 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 5.34 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.91 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 5.74 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.59 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 1.89 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 3.02 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 2.93 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 6.03 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 1.47 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 6.28 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 2.37 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 3.15 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 1.76 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.02 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 4.41 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 2.05 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.86 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.93 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.31 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 0.86 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 0.76 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 2.33 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.57 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 3.89 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.51 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 2.21 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.61 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 2.23 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 2.68 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.47 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 2.22 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 1.01 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.33 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 1.53 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 1.52 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 3.38 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.8 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.26 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.0 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 1.19 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 6.47 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 1.21 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 1.19 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 1.99 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.44 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 2.48 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 121.651 0.738 . . . . 1.37 112.039 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 2.64 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.2 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.51 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 1.78 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.57 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 1.07 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 1.62 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 1.26 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 4.57 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.33 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.53 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.06 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.87 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.66 113.823 -161.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 3.94 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 3.07 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.28 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 5.47 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.55 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 5.39 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.07 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 2.8 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.28 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 2.09 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 5.78 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 1.2 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 6.28 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 2.15 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 2.93 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.05 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.46 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.14 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 3.72 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 2.0 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.83 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.44 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.17 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 0.53 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 0.61 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 3.03 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.16 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 2.95 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 3.38 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 2.15 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.33 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.41 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.12 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 2.3 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.83 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 2.19 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 0.96 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.9 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 1.15 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.28 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 1.33 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 75' ' ' GLU . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.69 109.39 173.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 4.39 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 72' ' ' GLU . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 0.82 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 0.88 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.14 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 1.04 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 0.94 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.12 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 1.62 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 1.31 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.35 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 3.1 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.727 0.64 . . . . 1.12 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 2.7 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.08 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 2.2 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 1.7 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.89 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 1.41 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 1.74 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 1.82 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.28 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.51 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.486 HD23 ' CE1' ' A' ' 32' ' ' TYR . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 1.46 111.972 -177.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.61 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.53 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.66 111.831 -161.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 3.62 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 3.24 115.359 174.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.41 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 5.98 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.87 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 7.28 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.59 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.02 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.07 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 2.88 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 4.26 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 1.37 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.01 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 2.1 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.485 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.09 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.43 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 3.96 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 4.91 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 1.91 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.75 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 3.26 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.41 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 0.63 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 0.58 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 4.52 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.47 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 3.46 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.19 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 1.99 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.59 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.44 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 2.38 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 2.8 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.66 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 2.42 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 1.05 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.14 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 1.39 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 1.65 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 1.52 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.99 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 3.64 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.55 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.39 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.01 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.415 ' CD2' ' HD3' ' A' ' 84' ' ' PRO . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.15 111.923 170.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.34 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 1.38 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 1.38 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.42 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 1.75 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.14 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 77' ' ' LEU . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 2.84 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.813 0.339 . . . . 1.19 111.491 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 2.31 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.39 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.68 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 1.74 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 0.95 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.34 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 1.26 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 4.66 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 1.45 112.846 -178.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.67 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.11 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 3.43 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 2.62 114.93 -177.328 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.4 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 5.74 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 6.5 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 1.99 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.15 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 2.91 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 4.19 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 1.06 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 4.66 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 2.15 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 4.62 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.06 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 1.92 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 6.84 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 4.87 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 2.15 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.92 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.87 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 1.58 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 0.76 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 0.79 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 2.43 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.53 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.434 HH22 ' CD ' ' A' ' 72' ' ' GLU . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 4.04 112.821 163.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 2.67 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 2.12 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.44 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 2.32 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.06 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 1.78 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 1.88 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 1.2 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.14 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 1.3 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 1.25 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 1.46 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.434 ' CD ' HH22 ' A' ' 58' ' ' ARG . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.31 108.669 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 3.55 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 0.77 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 0.82 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 5.53 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.93 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 0.86 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.25 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 1.19 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 2.82 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.929 0.395 . . . . 1.23 111.669 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 2.82 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.09 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 1.82 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.65 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.12 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.65 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 1.26 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 6.65 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.19 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 1.34 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.3 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.6 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.46 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.0 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 3.68 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.34 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 5.89 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 3.8 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 1.85 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 2.46 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 2.1 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 5.25 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 1.1 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 4.67 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 2.12 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 4.64 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.19 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 1.47 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 4.21 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 4.74 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 2.07 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.74 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.41 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.18 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 0.45 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 0.6 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 1.92 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.72 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 72' ' ' GLU . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 4.27 112.64 167.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 3.21 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 1.89 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.05 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.43 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.467 HG13 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.19 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.467 ' H ' HG13 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.0 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.66 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 2.1 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 0.93 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 1.55 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 1.56 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 1.67 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 58' ' ' ARG . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.28 109.276 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 5.55 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.18 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.24 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 0.93 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 0.87 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 5.52 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 1.37 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 1.02 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.07 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 2.47 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 1.31 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.09 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 2.8 112.285 177.72 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 117.951 -1.024 . . . . 5.62 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.8 169.01 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.347 2.698 . . . . 2.68 113.203 -172.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 86.41 2.55 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.298 1.039 . . . . 1.98 111.213 174.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 2.52 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 3.38 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 2.63 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.22 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 1.45 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.12 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 1.55 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 5.86 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.62 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 1.59 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.94 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.42 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 1.98 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 3.95 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 2.8 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.26 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 5.23 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.12 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 1.85 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 2.43 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 2.11 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 5.55 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 1.26 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 4.59 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 2.65 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 2.76 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 1.99 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 4.6 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 3.64 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 2.04 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.02 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.57 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 2.56 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 0.51 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 0.71 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 3.21 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.41 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 2.36 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.03 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 1.87 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.36 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.56 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 2.33 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 3.29 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.09 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 2.21 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 1.58 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.88 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 2.35 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 2.48 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 2.4 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.14 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 5.47 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.66 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.65 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.11 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 1.35 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 5.32 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 1.11 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 0.88 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.44 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.3 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.46 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 2.4 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.231 -0.89 . . . . 3.28 109.682 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -82.61 158.62 16.58 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.388 2.725 . . . . 1.51 112.622 -178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m -97.54 68.35 2.13 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.122 -0.986 . . . . 1.24 111.869 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 3.31 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 2.56 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.4 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 1.65 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.57 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 1.33 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 1.51 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 1.36 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 5.76 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.51 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 1.76 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.42 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.55 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.76 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 2.88 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 3.28 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.26 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 4.98 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.91 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 3.69 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 2.37 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.03 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 2.34 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 6.1 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 1.35 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 4.46 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 2.43 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 4.67 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.34 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 1.7 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.16 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 5.62 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 1.89 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.02 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.5 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.36 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 0.58 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 0.74 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 1.83 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.4 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 2.63 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 2.85 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 2.42 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.46 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.5 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.1 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 2.61 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.54 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 2.6 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 1.07 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.07 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 1.38 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 1.74 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 1.67 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.62 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 3.73 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.38 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.58 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 0.97 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 1.08 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 4.62 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 0.98 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 0.95 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 2.61 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 1.66 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.35 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 2.48 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 . . . . . 0 N--CA 1.476 0.856 0 CA-C-O 117.95 -1.024 . . . . 4.54 109.693 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.82 128.07 8.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.131 2.554 . . . . 2.49 109.956 166.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m -99.15 84.45 3.04 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.041 -1.037 . . . . 1.59 112.221 -174.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 3.85 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 2.19 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.49 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 1.55 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.72 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.06 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 1.67 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 1.41 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 4.61 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.26 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.43 113.468 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.92 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.12 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.49 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 3.22 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.419 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 3.05 115.847 174.36 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 4.87 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.78 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 4.28 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 2.36 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.29 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 2.07 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 6.08 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 1.28 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 4.65 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 2.76 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 3.9 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.65 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.29 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 5.7 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 5.39 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 1.96 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.82 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.3 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 1.4 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 0.6 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 0.87 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 2.04 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.05 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 3.83 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 2.69 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 1.95 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.57 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 2.53 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 2.32 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 1.98 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 2.44 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 1.15 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.95 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 1.11 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 1.39 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 1.52 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 3.6 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.88 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 0.72 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 0.91 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 3.94 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 0.99 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 0.85 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 2.42 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 1.48 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.13 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 2.93 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 118.835 -0.602 . . . . 3.63 110.073 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -73.98 169.02 23.37 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.008 3.139 . . . . 2.1 111.329 170.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m -94.97 82.01 3.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.67 113.394 -177.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 3.92 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.26 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.72 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.24 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.15 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.07 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.32 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 1.66 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 4.88 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.64 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.72 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.17 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.82 113.052 -173.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 6.25 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 4.08 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.19 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 6.57 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.44 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 4.6 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.06 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 1.89 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 2.36 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 2.12 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 5.22 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 1.26 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 4.74 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 2.17 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 3.31 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.42 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 1.66 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 3.75 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 4.75 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 2.42 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.1 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.14 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 1.38 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 0.82 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 0.86 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 1.9 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.41 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.38 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.41 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 2.75 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.08 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 64' ' ' LYS . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 3.24 114.708 -161.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' H ' HG13 ' A' ' 63' ' ' VAL . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 1.88 112.818 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.11 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 2.29 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 1.45 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 2.17 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.08 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 2.18 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.12 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 4.62 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.31 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.69 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 0.94 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 0.92 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 4.47 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 1.43 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 1.43 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.23 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 2.69 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 1.85 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.42 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 3.07 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.582 ' N ' HD21 ' A' ' 14' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 118.433 -0.794 . . . . 3.87 109.526 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -63.62 156.66 55.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 121.559 1.506 . . . . 1.75 109.935 150.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -119.4 103.52 9.54 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.602 0.761 . . . . 1.14 112.115 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 2.52 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.03 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.73 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 1.7 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.94 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 0.98 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 1.74 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 1.29 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 6.08 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.1 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 1.41 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.85 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.14 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.57 112.416 -165.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 3.33 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 5.54 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 7.2 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.24 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 3.68 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.94 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 2.2 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.29 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 2.15 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 4.24 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 1.16 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 4.62 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 1.99 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 2.61 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.13 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.08 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 4.47 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 3.95 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 2.02 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.69 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.42 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 2.55 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 0.56 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 0.6 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 2.43 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 2.44 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 4.86 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 2.84 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 2.9 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 2.33 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 2.38 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.31 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 1.98 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 0.98 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.08 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 1.38 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 1.49 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 1.58 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 4.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.22 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.28 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 0.83 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.01 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.19 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 1.33 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 1.14 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 1.82 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.35 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.08 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 3.11 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.406 HD21 ' N ' ' A' ' 14' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 118.953 -0.546 . . . . 4.25 111.31 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -64.43 148.2 90.7 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.238 3.292 . . . . 2.24 112.817 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m -90.17 64.16 6.03 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.337 1.055 . . . . 1.5 113.169 -170.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 2.96 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 2.25 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.31 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 1.88 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.59 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 1.25 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 1.51 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 1.58 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 5.39 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 1.69 113.046 -178.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.51 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.68 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.84 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 4.2 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.424 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 2.86 115.553 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.63 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 6.58 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 3.65 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.07 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.1 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 2.04 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 4.02 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 1.63 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 4.46 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 2.76 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 3.52 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.84 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.19 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.19 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 4.84 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 2.18 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.08 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 1.56 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 0.52 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 0.69 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 2.68 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 2.89 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.53 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 1.79 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.35 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 1.87 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 1.9 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.36 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 1.98 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 1.12 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.36 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 1.93 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 2.23 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 2.34 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.53 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 4.99 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.429 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.12 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 1.14 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.03 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 3.79 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 1.15 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 0.95 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 1.8 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 1.38 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.43 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 2.56 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 118.019 -0.991 . . . . 3.11 109.352 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -57.64 147.57 78.87 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.963 1.776 . . . . 1.97 111.341 161.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.49 77.66 1.06 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.85 1.26 . . . . 1.79 113.863 -165.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 3.2 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.29 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.84 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 1.61 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.57 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 1.64 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 1.62 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 2.87 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 4.73 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.15 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.66 112.13 -175.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.44 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.35 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.52 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.12 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.505 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 4.47 114.091 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 6.46 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.83 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 4.0 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.31 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 1.75 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 2.62 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 2.45 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.464 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 4.64 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 1.63 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 4.91 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 2.7 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 3.38 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.52 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 5.97 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 4.98 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 2.13 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.05 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.7 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 1.38 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 0.58 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 1.14 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 2.3 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.62 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 3.6 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.08 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 2.59 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.29 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.22 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 4.65 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 2.52 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.45 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 3.38 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 1.69 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.36 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 1.92 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 1.6 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 1.44 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 3.51 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.42 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.76 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 0.97 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 1.31 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.15 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 1.44 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 1.79 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.18 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.61 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 1.86 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.45 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 3.05 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.657 -0.687 . . . . 3.86 110.783 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -69.4 173.71 10.25 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.073 3.182 . . . . 1.65 112.893 162.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m -122.83 88.52 2.94 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.792 1.237 . . . . 1.12 111.001 170.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 2.28 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 2.32 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.47 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 1.68 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.31 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 0.89 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 1.46 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.19 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 4.48 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.06 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.33 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.91 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.64 114.315 -159.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.09 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 3.72 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.74 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 4.46 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 3.45 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.9 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.13 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 1.95 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 2.07 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 5.81 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 1.38 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 ' C ' ' A' ' 85' ' ' TYR . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 4.48 112.689 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 2.26 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.08 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.23 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 1.48 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 3.93 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.26 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 1.99 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.72 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.01 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 0.47 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 0.61 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 2.3 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 3.8 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 2.79 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 2.19 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.3 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.65 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 2.27 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 2.15 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.14 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 2.0 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 1.15 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.98 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.15 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 1.27 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 1.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.26 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 3.58 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.93 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.09 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 0.75 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 0.82 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 5.41 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 0.92 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 0.97 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.15 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 2.73 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.1 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.405 ' C ' HH21 ' A' ' 43' ' ' ARG . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 2.52 112.85 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.611 -0.709 . . . . 3.88 110.98 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.04 151.16 86.7 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.234 2.623 . . . . 1.73 111.005 165.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 69.48 2.67 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.348 -0.845 . . . . 1.79 112.891 -169.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 2.67 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 2.09 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.44 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 2.3 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 1.88 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.3 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 2.2 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.13 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.09 112.813 -177.871 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.13 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.84 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 4.11 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.599 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 5.4 113.933 -171.179 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 6.63 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.3 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 4.84 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.17 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 3.07 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 3.66 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 2.63 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 4.5 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 2.19 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 4.44 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 2.83 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 3.71 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.82 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.15 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 3.64 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 4.71 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 1.99 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.16 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.97 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.28 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 0.58 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 0.88 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 2.12 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.431 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.03 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 2.35 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 2.92 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 1.98 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.12 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.34 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 2.2 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 3.09 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.19 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 2.17 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 1.76 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.68 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 1.96 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 2.2 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 2.16 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.01 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 4.83 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.35 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.01 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.32 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 1.31 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 5.42 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 1.61 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.11 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.2 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 1.66 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.61 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.57 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 3.12 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 118.214 -0.898 . . . . 3.75 110.385 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -69.67 170.37 16.63 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.574 2.849 . . . . 1.76 113.468 167.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -110.24 77.93 1.09 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.36 112.695 -173.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 3.12 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 1.88 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.26 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 1.79 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.82 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.07 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.17 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 1.51 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 5.6 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.32 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 1.38 112.533 -176.51 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.13 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.64 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.01 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 4.01 114.678 -173.513 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.8 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 4.7 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.72 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 4.63 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.11 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.3 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.24 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 2.16 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 6.13 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.0 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 4.37 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 2.4 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 2.92 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.04 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.63 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 4.56 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 4.98 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 1.86 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.69 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.62 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.33 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 0.53 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 0.64 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 2.12 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.48 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 2.53 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 4.76 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 1.92 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.11 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.39 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 1.87 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 2.52 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.72 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 1.95 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 0.98 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.17 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 1.36 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 1.3 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 1.59 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.34 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 5.77 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.58 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.32 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.02 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 1.09 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 4.9 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.09 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.05 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.18 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 1.84 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.17 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.92 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 3.33 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.323 -0.846 . . . . 4.02 109.533 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -81.57 147.92 15.86 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.756 2.971 . . . . 2.44 111.732 170.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m -87.27 72.57 9.84 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.53 113.515 -170.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 3.21 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 1.91 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.19 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 1.78 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.93 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.3 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.36 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 1.89 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 4.92 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.36 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 32' ' ' TYR . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.36 113.699 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.94 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.51 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.51 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 3.87 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.52 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 2.68 115.264 -172.268 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.3 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.28 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.26 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 4.94 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.06 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 2.57 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.36 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 2.37 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 4.34 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 1.3 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 5.75 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 2.94 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 3.07 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.39 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 1.78 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 7.9 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 4.43 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 2.28 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.85 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.82 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.22 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 0.84 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 0.96 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 2.69 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.56 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 4.39 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 3.83 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 2.71 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.29 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.9 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 2.56 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 2.41 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.53 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 3.1 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.33 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.15 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 1.31 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.32 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.19 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 3.74 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.4 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 1.04 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 0.94 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 4.7 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.05 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.14 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.62 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 1.57 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.57 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 3.01 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.3 m120 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 118.771 -0.633 . . . . 4.55 110.078 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.51 157.94 59.44 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.122 2.548 . . . . 3.33 111.646 168.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -95.86 85.14 4.01 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.6 111.687 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 4.57 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 3.72 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 2.39 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 1.83 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 1.7 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 1.62 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 1.57 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 5.87 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 32' ' ' TYR . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.84 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.43 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.03 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.405 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 3.14 116.239 178.84 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.18 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 5.93 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.36 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 4.94 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.22 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 2.79 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 2.86 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 5.89 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 1.5 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.08 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 2.91 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.03 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.88 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.45 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 6.86 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 3.53 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 2.11 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.1 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.47 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.42 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 76' ' ' ILE . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 0.66 110.693 173.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 1.19 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 2.13 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.66 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 3.54 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 3.74 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 3.5 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.4 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.03 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 3.44 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.02 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.59 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 2.96 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 1.31 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.9 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 1.74 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 2.47 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 2.87 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.51 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 4.66 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.09 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.438 HD13 HG21 ' A' ' 54' ' ' ILE . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 1.56 111.14 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 1.8 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 7.62 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 1.73 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 1.85 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.05 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.44 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.02 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.89 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.81 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 118.732 -0.651 . . . . 3.09 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -53.14 121.47 9.45 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 108.334 -1.449 . . . . 2.31 108.334 153.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.79 62.79 2.32 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 1.83 112.204 -156.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 2.65 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.06 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.27 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.36 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.56 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 1.05 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.35 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 1.56 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 5.51 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.82 112.917 -176.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.95 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.56 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.11 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 4.99 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.512 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 3.23 115.549 -179.244 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.01 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.22 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.12 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.98 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 1.87 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.21 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 2.22 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 5.09 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 1.32 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 5.33 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 2.35 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 2.6 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.19 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 4.25 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 4.51 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 2.17 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 0.93 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 1.45 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 0.59 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 0.84 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 2.69 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.4 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 2.75 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 3.75 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 2.66 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.58 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.07 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.514 HG13 ' H ' ' A' ' 64' ' ' LYS . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 2.43 113.771 -164.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.514 ' H ' HG13 ' A' ' 63' ' ' VAL . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 2.64 113.563 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.1 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 2.39 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 1.51 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.08 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.25 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 1.32 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.05 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.01 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.39 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 0.88 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 1.15 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 4.68 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 1.59 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 1.53 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.39 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 1.73 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.85 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.04 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 118.951 -0.547 . . . . 6.08 110.451 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.13 168.77 16.64 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.481 2.787 . . . . 2.88 112.707 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.34 73.4 10.48 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.009 -1.057 . . . . 1.44 111.384 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 2.17 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 1.94 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 2.74 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 1.62 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.53 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 1.06 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.39 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 1.53 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 5.62 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.16 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 1.33 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.84 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.83 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.44 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.1 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 4.39 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.55 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 6.7 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.37 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 3.82 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.85 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.21 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.18 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 2.13 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 4.57 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 1.14 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 5.7 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 2.63 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 3.85 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.09 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 1.62 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 4.8 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 4.73 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 2.29 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.74 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.23 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 0.47 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 0.7 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 2.35 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.38 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 2.43 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.44 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 1.7 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.03 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.05 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 2.26 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.66 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 2.29 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.07 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.96 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 1.15 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 1.57 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 1.58 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 4.96 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.47 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.53 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.86 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 0.85 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 4.86 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 0.98 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 0.97 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.88 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.28 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.07 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 2.24 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.442 -0.577 . . . . 3.28 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -59.55 141.35 97.13 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.273 1.315 . . . . 1.6 110.059 151.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.12 80.72 5.63 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.479 -0.763 . . . . 1.49 111.666 -176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 2.15 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 1.79 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.84 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.48 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.43 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 1.46 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 1.58 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 2.12 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 6.41 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.76 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.32 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.42 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.67 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.1 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 4.24 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 3.57 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 4.79 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.26 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 4.24 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 1.71 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 2.85 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 2.1 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 4.17 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 1.52 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 5.49 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 2.5 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 3.69 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 1.88 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 7.0 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 4.22 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 2.01 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.39 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 1.62 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 0.59 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 1.17 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 2.28 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 2.56 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.411 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 3.64 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 3.47 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 3.88 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 1.94 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 2.37 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 2.5 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.58 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 2.59 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 1.9 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.41 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 1.66 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 2.37 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 2.48 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 3.44 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.58 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 1.37 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 1.6 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 6.74 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 1.43 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 0.96 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.55 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.94 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 1.74 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.61 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 2.51 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 118.982 -0.533 . . . . 3.31 110.239 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -59.78 164.86 10.94 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.843 2.362 . . . . 1.7 111.198 152.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.33 84.42 1.97 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.29 113.271 -169.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 2.96 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.09 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.34 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 1.82 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.64 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.17 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 1.58 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 1.94 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 8.43 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.32 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.56 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 1.4 113.038 -173.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.13 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.72 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.09 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.56 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 3.1 114.782 179.03 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.65 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 5.34 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.91 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 5.74 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.59 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 1.89 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 3.02 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 2.93 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 6.03 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 1.47 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 6.28 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 2.37 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 3.15 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 1.76 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.02 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 4.41 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 2.05 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.86 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.93 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.31 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 0.86 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 0.76 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 2.33 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.57 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 3.89 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.51 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 2.21 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.61 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 2.23 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 2.68 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.47 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 2.22 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 1.01 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.33 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 1.53 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 1.52 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 3.38 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.8 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.26 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.0 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 1.19 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 6.47 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 1.21 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 1.19 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 1.99 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.44 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 2.48 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 118.76 -0.638 . . . . 3.12 109.433 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -56.39 132.22 50.52 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 N-CA-C 108.564 -1.36 . . . . 2.1 108.564 152.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m -80.97 79.86 7.56 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.461 -0.774 . . . . 1.37 112.039 -174.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 2.64 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.2 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.51 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 1.78 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.57 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 1.07 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 1.62 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 1.26 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 4.57 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.33 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.53 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.06 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.87 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.66 113.823 -161.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 3.94 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 3.07 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.28 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 5.47 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.55 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 5.39 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.07 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 2.8 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.28 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 2.09 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 5.78 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 1.2 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 6.28 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 2.15 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 2.93 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.05 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.46 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.14 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 3.72 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 2.0 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.83 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.44 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.17 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 0.53 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 0.61 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 3.03 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.16 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 2.95 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 3.38 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 2.15 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.33 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.41 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.12 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 2.3 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.83 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 2.19 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 0.96 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.9 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 1.15 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.28 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 1.33 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 75' ' ' GLU . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.69 109.39 173.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 4.39 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 72' ' ' GLU . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 0.82 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 0.88 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.14 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 1.04 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 0.94 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.12 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 1.62 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 1.31 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.35 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 3.1 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 118.806 -0.616 . . . . 3.32 109.958 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -63.91 138.37 62.59 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 122.145 1.897 . . . . 1.67 109.801 168.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -91.39 58.37 3.59 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.454 -0.778 . . . . 1.12 112.727 -164.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 2.7 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.08 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 2.2 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 1.7 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.89 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 1.41 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 1.74 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 1.82 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.28 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.51 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.486 HD23 ' CE1' ' A' ' 32' ' ' TYR . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 1.46 111.972 -177.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.61 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.53 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.66 111.831 -161.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 3.62 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 3.24 115.359 174.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.41 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 5.98 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.87 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 7.28 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.59 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.02 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.07 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 2.88 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 4.26 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 1.37 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.01 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 2.1 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.485 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.09 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.43 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 3.96 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 4.91 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 1.91 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.75 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 3.26 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.41 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 0.63 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 0.58 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 4.52 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.47 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 3.46 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.19 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 1.99 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.59 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.44 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 2.38 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 2.8 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.66 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 2.42 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 1.05 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.14 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 1.39 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 1.65 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 1.52 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.99 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 3.64 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.55 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.39 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.01 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.415 ' CD2' ' HD3' ' A' ' 84' ' ' PRO . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.15 111.923 170.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.34 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 1.38 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 1.38 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.42 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 1.75 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.14 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 77' ' ' LEU . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 2.84 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.614 -0.708 . . . . 3.64 110.083 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -76.86 170.71 19.31 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.576 2.851 . . . . 1.46 110.9 164.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m -106.23 87.97 2.68 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.904 0.881 . . . . 1.19 111.491 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 2.31 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.39 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.68 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 1.74 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 0.95 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.34 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 1.26 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 4.66 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 1.45 112.846 -178.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.67 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.11 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 3.43 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 2.62 114.93 -177.328 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.4 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 5.74 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 6.5 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 1.99 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.15 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 2.91 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 4.19 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 1.06 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 4.66 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 2.15 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 4.62 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.06 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 1.92 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 6.84 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 4.87 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 2.15 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.92 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.87 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 1.58 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 0.76 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 0.79 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 2.43 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.53 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.434 HH22 ' CD ' ' A' ' 72' ' ' GLU . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 4.04 112.821 163.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 2.67 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 2.12 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.44 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 2.32 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.06 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 1.78 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 1.88 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 1.2 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.14 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 1.3 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 1.25 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 1.46 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.434 ' CD ' HH22 ' A' ' 58' ' ' ARG . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.31 108.669 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 3.55 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 0.77 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 0.82 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 5.53 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.93 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 0.86 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.25 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 1.19 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 2.82 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 119.396 -0.335 . . . . 4.64 111.648 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -71.33 166.33 29.62 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.908 2.405 . . . . 1.8 110.982 151.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -113.38 77.27 1.04 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.191 0.996 . . . . 1.23 111.669 175.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 2.82 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.09 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 1.82 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.65 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.12 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.65 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 1.26 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 6.65 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.19 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 1.34 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.3 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.6 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.46 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.0 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 3.68 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.34 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 5.89 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 3.8 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 1.85 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 2.46 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 2.1 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 5.25 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 1.1 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 4.67 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 2.12 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 4.64 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.19 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 1.47 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 4.21 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 4.74 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 2.07 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.74 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.41 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.18 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 0.45 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 0.6 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 1.92 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.72 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 72' ' ' GLU . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 4.27 112.64 167.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 3.21 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 1.89 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.05 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.43 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.467 HG13 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.19 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.467 ' H ' HG13 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.0 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.66 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 2.1 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 0.93 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 1.55 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 1.56 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 1.67 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 58' ' ' ARG . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.28 109.276 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 5.55 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.18 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.24 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 0.93 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 0.87 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 5.52 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 1.37 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 1.02 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.07 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 2.47 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 1.31 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.09 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 2.8 112.285 177.72 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.541 0.627 0 CA-C-O 121.319 0.581 . . . . 1.98 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 2.52 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 3.3799999999999999 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 2.6299999999999999 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.2200000000000002 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 1.45 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.1200000000000001 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 1.55 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 5.8600000000000003 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.6200000000000001 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 1.5900000000000001 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.9399999999999999 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.4199999999999999 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 1.98 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 3.9500000000000002 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 2.7999999999999998 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.2599999999999998 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 5.2300000000000004 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7000000000000002 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.1200000000000001 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 1.8500000000000001 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 2.4300000000000002 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 2.1099999999999999 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 5.5499999999999998 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 1.26 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 4.5899999999999999 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 2.6499999999999999 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 2.7599999999999998 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 1.99 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 4.5999999999999996 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 3.6400000000000001 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 2.04 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.02 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.5700000000000001 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 2.5600000000000001 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 0.51000000000000001 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 0.70999999999999996 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 3.21 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.4099999999999999 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 2.3599999999999999 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.0299999999999998 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 1.8700000000000001 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.3599999999999999 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.5600000000000001 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 2.3300000000000001 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 3.29 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.0899999999999999 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 2.21 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 1.5800000000000001 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.8799999999999999 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 2.3500000000000001 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 2.48 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 2.3999999999999999 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.1400000000000001 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 5.4699999999999998 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.6600000000000001 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.6499999999999999 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.1100000000000001 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 1.3500000000000001 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 5.3200000000000003 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 1.1100000000000001 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 0.88 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.4399999999999999 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.2999999999999998 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.46 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 2.3999999999999999 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m . . . . . 0 CA--C 1.54 0.588 0 CA-C-O 121.605 0.717 . . . . 1.24 111.869 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 3.3100000000000001 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 2.5600000000000001 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.3999999999999999 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 1.6499999999999999 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.5699999999999998 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 1.3300000000000001 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 1.51 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 1.3600000000000001 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 5.7599999999999998 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.51 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 1.76 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.4199999999999999 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.5499999999999998 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.76 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 2.8799999999999999 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 3.2799999999999998 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.2599999999999998 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 4.9800000000000004 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.9100000000000001 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 3.6899999999999999 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 2.3700000000000001 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.0299999999999998 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 2.3399999999999999 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 6.0999999999999996 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 1.3500000000000001 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 4.46 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 2.4300000000000002 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 4.6699999999999999 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.3400000000000001 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 1.7 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.1600000000000001 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 5.6200000000000001 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 1.8899999999999999 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.02 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.5 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.3600000000000001 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 0.57999999999999996 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 0.73999999999999999 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 1.8300000000000001 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.3999999999999999 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 2.6299999999999999 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 2.8500000000000001 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 2.4199999999999999 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.46 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.5 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.1000000000000001 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 2.6099999999999999 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.54 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 2.6000000000000001 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 1.0700000000000001 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.0700000000000001 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 1.3799999999999999 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 1.74 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 1.6699999999999999 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.6200000000000001 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 3.73 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.3799999999999999 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.5800000000000001 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 0.96999999999999997 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 1.0800000000000001 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 4.6200000000000001 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 0.97999999999999998 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 0.94999999999999996 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 2.6099999999999999 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 1.6599999999999999 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.3500000000000001 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 2.48 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.59 0.709 . . . . 1.5900000000000001 112.221 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 3.8500000000000001 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 2.1899999999999999 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.4900000000000002 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 1.55 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.7200000000000002 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.0600000000000001 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 1.6699999999999999 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 1.4099999999999999 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 4.6100000000000003 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.26 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.4299999999999999 113.468 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.9199999999999999 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.1200000000000001 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.49 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 3.2200000000000002 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.419 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 3.0499999999999998 115.847 174.36 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2000000000000002 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 4.8700000000000001 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.7799999999999998 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 4.2800000000000002 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 2.3599999999999999 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.29 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 2.0699999999999998 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 6.0800000000000001 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 1.28 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 4.6500000000000004 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 2.7599999999999998 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 3.8999999999999999 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.6499999999999999 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.29 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 5.7000000000000002 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 5.3899999999999997 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 1.96 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.81999999999999995 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.2999999999999998 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 1.3999999999999999 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 0.59999999999999998 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 0.87 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 2.04 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.0499999999999998 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 3.8300000000000001 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 2.6899999999999999 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 1.95 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.5699999999999998 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 2.5299999999999998 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 2.3199999999999998 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 1.98 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 2.4399999999999999 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 1.1499999999999999 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.94999999999999996 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 1.1100000000000001 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 1.3899999999999999 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 1.52 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2000000000000002 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 3.6000000000000001 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.8799999999999999 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 0.71999999999999997 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 0.91000000000000003 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 3.9399999999999999 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 0.98999999999999999 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 0.84999999999999998 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 2.4199999999999999 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 1.48 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.1299999999999999 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 2.9300000000000002 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.6699999999999999 113.394 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 3.9199999999999999 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.2599999999999998 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.7200000000000002 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.2400000000000002 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.1499999999999999 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.0700000000000001 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.3200000000000001 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 1.6599999999999999 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 4.8799999999999999 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.6399999999999999 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.7200000000000002 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.1699999999999999 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.8199999999999998 113.052 -173.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 6.25 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 4.0800000000000001 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.1899999999999999 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 6.5700000000000003 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.4399999999999999 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 4.5999999999999996 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.0600000000000001 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 1.8899999999999999 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 2.3599999999999999 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 2.1200000000000001 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 5.2199999999999998 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 1.26 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 4.7400000000000002 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 2.1699999999999999 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 3.3100000000000001 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.4199999999999999 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 1.6599999999999999 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 3.75 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 4.75 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 2.4199999999999999 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.1000000000000001 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.1400000000000001 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 1.3799999999999999 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 0.81999999999999995 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 0.85999999999999999 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 1.8999999999999999 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.4099999999999999 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.3799999999999999 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.4100000000000001 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 2.75 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.0800000000000001 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 64' ' ' LYS . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 3.2400000000000002 114.708 -161.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.438 ' H ' HG13 ' A' ' 63' ' ' VAL . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 1.8799999999999999 112.818 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.1099999999999999 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 2.29 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 1.45 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 2.1699999999999999 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.0800000000000001 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 2.1800000000000002 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.1200000000000001 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 4.6200000000000001 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.3100000000000001 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.6899999999999999 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 0.93999999999999995 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 0.92000000000000004 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 4.4699999999999998 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 1.4299999999999999 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 1.4299999999999999 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.23 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 2.6899999999999999 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 1.8500000000000001 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.4199999999999999 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 3.0699999999999998 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.428 0.632 . . . . 1.1399999999999999 112.115 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 2.52 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.0299999999999998 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.73 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 1.7 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.9399999999999999 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 0.97999999999999998 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 1.74 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 1.29 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 6.0800000000000001 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.1000000000000001 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 1.4099999999999999 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.8500000000000001 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.1400000000000001 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.5700000000000001 112.416 -165.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 3.3300000000000001 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 5.54 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 7.2000000000000002 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.2400000000000002 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 3.6800000000000002 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.93999999999999995 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 2.2000000000000002 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.29 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 2.1499999999999999 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 4.2400000000000002 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 1.1599999999999999 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 4.6200000000000001 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 1.99 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 2.6099999999999999 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.1299999999999999 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.0800000000000001 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 4.4699999999999998 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 3.9500000000000002 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 2.02 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.68999999999999995 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.4199999999999999 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 2.5499999999999998 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 0.56000000000000005 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 0.59999999999999998 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 2.4300000000000002 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 2.4399999999999999 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 4.8600000000000003 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 2.8399999999999999 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 2.8999999999999999 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 2.3300000000000001 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 2.3799999999999999 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.3100000000000001 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 1.98 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 0.97999999999999998 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.0800000000000001 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 1.3799999999999999 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 1.49 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 1.5800000000000001 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2000000000000002 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 4.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.2200000000000002 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.2799999999999998 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 0.82999999999999996 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.01 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.1900000000000004 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 1.3300000000000001 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 1.1399999999999999 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 1.8200000000000001 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.3500000000000001 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.0800000000000001 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 3.1099999999999999 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 122.202 1.001 . . . . 1.5 113.169 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 2.96 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 2.25 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.3100000000000001 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 1.8799999999999999 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.5899999999999999 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 1.25 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 1.51 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 1.5800000000000001 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 5.3899999999999997 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 1.6899999999999999 113.046 -178.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.5099999999999998 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.6800000000000002 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.8400000000000001 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 4.2000000000000002 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.424 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 2.8599999999999999 115.553 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.6299999999999999 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 6.5800000000000001 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 3.6499999999999999 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91000000000000003 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.0699999999999998 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.1000000000000001 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 2.04 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 4.0199999999999996 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 1.6299999999999999 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 4.46 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 2.7599999999999998 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 3.52 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.8400000000000001 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.1899999999999999 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.1900000000000004 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 4.8399999999999999 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 2.1800000000000002 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.0800000000000001 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 1.5600000000000001 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 0.52000000000000002 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 0.68999999999999995 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 2.6800000000000002 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 2.8900000000000001 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.5299999999999998 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 1.79 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.3500000000000001 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 1.8700000000000001 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 1.8999999999999999 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.3600000000000001 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 1.98 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 1.1200000000000001 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.3600000000000001 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 1.9299999999999999 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 2.23 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 2.3399999999999999 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.5299999999999998 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 4.9900000000000002 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.429 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.1200000000000001 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7000000000000002 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 1.1399999999999999 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.03 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 3.79 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 1.1499999999999999 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 0.94999999999999996 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 1.8 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 1.3799999999999999 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.4299999999999999 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 2.5600000000000001 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 113.863 1.06 . . . . 1.79 113.863 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 3.2000000000000002 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.29 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.8399999999999999 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 1.6100000000000001 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.5699999999999998 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 1.6399999999999999 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 1.6200000000000001 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 2.8700000000000001 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 4.7300000000000004 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.1499999999999999 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.6600000000000001 112.13 -175.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.4400000000000004 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.3499999999999996 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.52 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.1200000000000001 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.505 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 4.4699999999999998 114.091 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 6.46 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.8300000000000001 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 4.0 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.3100000000000001 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 1.75 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 2.6200000000000001 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 2.4500000000000002 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.464 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 4.6399999999999997 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 1.6299999999999999 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 4.9100000000000001 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 2.7000000000000002 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 3.3799999999999999 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.52 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 5.9699999999999998 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 4.9800000000000004 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 2.1299999999999999 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.05 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.7 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 1.3799999999999999 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 0.57999999999999996 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 1.1399999999999999 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 2.2999999999999998 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.6200000000000001 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 3.6000000000000001 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.0800000000000001 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 2.5899999999999999 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.29 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.2200000000000002 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 4.6500000000000004 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 2.52 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.4500000000000002 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 3.3799999999999999 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 1.6899999999999999 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.3600000000000001 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 1.9199999999999999 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 1.6000000000000001 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 1.4399999999999999 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 3.5099999999999998 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.4199999999999999 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.7599999999999998 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 0.96999999999999997 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 1.3100000000000001 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.1500000000000004 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 1.4399999999999999 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 1.79 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.1800000000000002 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.6099999999999999 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 1.8600000000000001 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.45 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 3.0499999999999998 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.542 0.657 0 CA-C-O 121.258 0.551 . . . . 1.1200000000000001 111.001 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 2.2799999999999998 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 2.3199999999999998 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.4700000000000002 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 1.6799999999999999 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.3100000000000001 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 0.89000000000000001 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 1.46 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.1899999999999999 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 4.4800000000000004 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.0600000000000001 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.3300000000000001 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.9100000000000001 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.6399999999999999 114.315 -159.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.0899999999999999 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 3.7200000000000002 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.7400000000000002 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 4.46 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7000000000000002 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 3.4500000000000002 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.90000000000000002 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.1299999999999999 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 1.95 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 2.0699999999999998 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 5.8099999999999996 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 1.3799999999999999 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 ' C ' ' A' ' 85' ' ' TYR . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 4.4800000000000004 112.689 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 2.2599999999999998 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.0800000000000001 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.23 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 1.48 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 3.9300000000000002 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.2599999999999998 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 1.99 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.71999999999999997 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.0099999999999998 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 0.46999999999999997 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 0.60999999999999999 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 2.2999999999999998 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 3.7999999999999998 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 2.79 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 2.1899999999999999 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.2999999999999998 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.6499999999999999 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 2.27 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 2.1499999999999999 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.1400000000000001 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 2.0 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 1.1499999999999999 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.97999999999999998 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.1499999999999999 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 1.27 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 1.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.2599999999999998 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 3.5800000000000001 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.9299999999999999 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.0899999999999999 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 0.75 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 0.81999999999999995 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 5.4100000000000001 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 0.92000000000000004 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 0.96999999999999997 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.1499999999999999 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 2.73 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.1000000000000001 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . 0.405 ' C ' HH21 ' A' ' 43' ' ' ARG . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 2.52 112.85 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.698 0.761 . . . . 1.79 112.891 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 2.6699999999999999 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 2.0899999999999999 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.4399999999999999 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 2.2999999999999998 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 1.8799999999999999 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.3 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 2.2000000000000002 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.1299999999999999 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.0899999999999999 112.813 -177.871 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.1299999999999999 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.8400000000000001 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 4.1100000000000003 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.599 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 5.4000000000000004 113.933 -171.179 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 6.6299999999999999 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.2999999999999998 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 4.8399999999999999 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.1699999999999999 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 3.0699999999999998 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 3.6600000000000001 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 2.6299999999999999 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 4.5 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 2.1899999999999999 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 4.4400000000000004 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 2.8300000000000001 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 3.71 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.8200000000000001 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.1499999999999999 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 3.6400000000000001 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 4.71 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 1.99 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.1599999999999999 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.9700000000000002 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.28 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 0.57999999999999996 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 0.88 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 2.1200000000000001 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.431 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.0299999999999998 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 2.3500000000000001 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 2.9199999999999999 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 1.98 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.1200000000000001 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.3400000000000001 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 2.2000000000000002 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 3.0899999999999999 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.1899999999999999 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 2.1699999999999999 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 1.76 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.6799999999999999 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 1.96 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 2.2000000000000002 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 2.1600000000000001 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.0099999999999998 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 4.8300000000000001 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.3500000000000001 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.0099999999999998 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.3200000000000001 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 1.3100000000000001 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 5.4199999999999999 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 1.6100000000000001 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.1100000000000001 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.2 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 1.6599999999999999 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.6100000000000001 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.5700000000000001 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 3.1200000000000001 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.3600000000000001 112.695 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 3.1200000000000001 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 1.8799999999999999 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.2599999999999998 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 1.79 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.8199999999999998 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.0700000000000001 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.1699999999999999 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 1.51 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 5.5999999999999996 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.3200000000000001 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 1.3799999999999999 112.533 -176.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.1299999999999999 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.6399999999999999 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.0099999999999998 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 4.0099999999999998 114.678 -173.513 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.7999999999999998 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 4.7000000000000002 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.7200000000000002 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 4.6299999999999999 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.1100000000000001 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.2999999999999998 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.2400000000000002 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 2.1600000000000001 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 6.1299999999999999 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.0 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 4.3700000000000001 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 2.3999999999999999 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 2.9199999999999999 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.04 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.6299999999999999 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 4.5599999999999996 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 4.9800000000000004 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 1.8600000000000001 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.68999999999999995 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.6200000000000001 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.3300000000000001 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 0.53000000000000003 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 0.64000000000000001 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 2.1200000000000001 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.48 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 2.5299999999999998 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 4.7599999999999998 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 1.9199999999999999 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.1099999999999999 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.3899999999999999 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 1.8700000000000001 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 2.52 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.72 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 1.95 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 0.97999999999999998 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.1699999999999999 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 1.3600000000000001 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 1.3 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 1.5900000000000001 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.3399999999999999 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 5.7699999999999996 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.5800000000000001 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.3199999999999998 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.02 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 1.0900000000000001 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 4.9000000000000004 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.0900000000000001 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.05 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.1799999999999999 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 1.8400000000000001 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.1699999999999999 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.9199999999999999 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 3.3300000000000001 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.53 113.515 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 3.21 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 1.9099999999999999 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.1899999999999999 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 1.78 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.9300000000000002 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.3 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.3600000000000001 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 1.8899999999999999 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 4.9199999999999999 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.3600000000000001 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 32' ' ' TYR . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.3600000000000001 113.699 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.9399999999999999 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.5099999999999998 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.51 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 3.8700000000000001 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.52 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 2.6800000000000002 115.264 -172.268 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.2999999999999998 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.2800000000000002 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.2599999999999998 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 4.9400000000000004 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.0600000000000001 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 2.5699999999999998 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.3599999999999999 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 2.3700000000000001 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 4.3399999999999999 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 1.3 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 5.75 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 2.9399999999999999 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 3.0699999999999998 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.3899999999999999 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 1.78 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 7.9000000000000004 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 4.4299999999999997 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 2.2799999999999998 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.84999999999999998 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.8200000000000001 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.2200000000000002 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 0.83999999999999997 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 0.95999999999999996 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 2.6899999999999999 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.5600000000000001 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 4.3899999999999997 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 3.8300000000000001 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 2.71 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.29 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.8999999999999999 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 2.5600000000000001 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 2.4100000000000001 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.53 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 3.1000000000000001 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.3300000000000001 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1000000000000001 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.1499999999999999 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 1.3100000000000001 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.3200000000000001 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.1899999999999999 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 3.7400000000000002 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.3999999999999999 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6000000000000001 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 1.04 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 0.93999999999999995 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 4.7000000000000002 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.05 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.1399999999999999 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.6200000000000001 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 1.5700000000000001 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.5700000000000001 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 3.0099999999999998 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.6000000000000001 111.687 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 4.5700000000000003 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 3.7200000000000002 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 2.3900000000000001 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 1.8300000000000001 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 1.7 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 1.6200000000000001 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 1.5700000000000001 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 5.8700000000000001 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 32' ' ' TYR . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.8399999999999999 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.4300000000000002 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.0300000000000002 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.405 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 3.1400000000000001 116.239 178.84 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.1800000000000002 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 5.9299999999999997 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.3599999999999999 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 4.9400000000000004 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.2200000000000002 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 2.79 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 2.8599999999999999 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 5.8899999999999997 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 1.5 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.0800000000000001 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 2.9100000000000001 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.0300000000000002 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.8799999999999999 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.4500000000000002 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 6.8600000000000003 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 3.5299999999999998 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 2.1099999999999999 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.1000000000000001 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.4700000000000002 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.4199999999999999 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 76' ' ' ILE . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 0.66000000000000003 110.693 173.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 1.1899999999999999 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 2.1299999999999999 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.6599999999999999 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 3.54 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 3.7400000000000002 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 3.5 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.3999999999999999 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.0299999999999998 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 3.4399999999999999 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.02 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.5900000000000001 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 2.96 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 1.3100000000000001 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.90000000000000002 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 1.74 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 2.4700000000000002 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 2.8700000000000001 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.5099999999999998 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 4.6600000000000001 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.0899999999999999 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.438 HD13 HG21 ' A' ' 54' ' ' ILE . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 1.5600000000000001 111.14 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 1.8 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 7.6200000000000001 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 1.73 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 1.8500000000000001 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.0499999999999998 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.4399999999999999 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.02 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.8899999999999999 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.8100000000000001 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 1.8300000000000001 112.204 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 2.6499999999999999 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.0600000000000001 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.27 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.3600000000000001 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.5600000000000001 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 1.05 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.3500000000000001 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 1.5600000000000001 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 5.5099999999999998 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.8200000000000001 112.917 -176.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.9500000000000002 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.5600000000000001 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.1099999999999999 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 4.9900000000000002 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.512 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 3.23 115.549 -179.244 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.0099999999999998 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.2199999999999998 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.1200000000000001 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.97999999999999998 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 1.8700000000000001 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.21 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 2.2200000000000002 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 5.0899999999999999 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 1.3200000000000001 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 5.3300000000000001 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 2.3500000000000001 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 2.6000000000000001 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.1899999999999999 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 4.25 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 4.5099999999999998 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 2.1699999999999999 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 0.93000000000000005 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 1.45 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 0.58999999999999997 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 0.83999999999999997 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 2.6899999999999999 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.3999999999999999 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 2.75 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 3.75 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 2.6600000000000001 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.5800000000000001 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.0699999999999998 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.514 HG13 ' H ' ' A' ' 64' ' ' LYS . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 2.4300000000000002 113.771 -164.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.514 ' H ' HG13 ' A' ' 63' ' ' VAL . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 2.6400000000000001 113.563 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.1000000000000001 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 2.3900000000000001 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 1.51 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.0800000000000001 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.25 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 1.3200000000000001 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.0499999999999998 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.0099999999999998 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.3900000000000001 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 0.88 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 1.1499999999999999 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 4.6799999999999997 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 1.5900000000000001 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 1.53 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.3900000000000001 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 1.73 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.8500000000000001 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.04 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.544 0.719 0 CA-C-O 121.155 0.502 . . . . 1.4399999999999999 111.384 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 2.1699999999999999 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 1.9399999999999999 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 2.7400000000000002 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 1.6200000000000001 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.5299999999999998 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 1.0600000000000001 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.3899999999999999 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 1.53 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 5.6200000000000001 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.1599999999999999 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 1.3300000000000001 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.8399999999999999 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.8300000000000001 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.4399999999999999 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.1000000000000001 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 4.3899999999999997 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.5499999999999998 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 6.7000000000000002 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.3700000000000001 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 3.8199999999999998 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.84999999999999998 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.21 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.1800000000000002 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 2.1299999999999999 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 4.5700000000000003 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 1.1399999999999999 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 5.7000000000000002 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 2.6299999999999999 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 3.8500000000000001 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.0900000000000001 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 1.6200000000000001 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 4.7999999999999998 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 4.7300000000000004 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 2.29 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.73999999999999999 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.23 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 0.46999999999999997 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 0.69999999999999996 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 2.3500000000000001 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.3799999999999999 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 2.4300000000000002 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.4399999999999999 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 1.7 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.0299999999999998 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.0499999999999998 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 2.2599999999999998 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.6599999999999999 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 2.29 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.0700000000000001 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.95999999999999996 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 1.1499999999999999 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 1.5700000000000001 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 1.5800000000000001 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 4.96 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.4700000000000002 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.5299999999999998 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.85999999999999999 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 0.84999999999999998 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 4.8600000000000003 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 0.97999999999999998 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 0.96999999999999997 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.8799999999999999 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.28 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.0700000000000001 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 2.2400000000000002 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 121.439 0.638 . . . . 1.49 111.666 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 2.1499999999999999 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 1.79 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.8399999999999999 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.48 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.4300000000000002 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 1.46 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 1.5800000000000001 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 2.1200000000000001 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 6.4100000000000001 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.76 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.3199999999999998 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.4199999999999999 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.6699999999999999 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.1000000000000001 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 4.2400000000000002 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 3.5699999999999998 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 4.79 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.2599999999999998 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 4.2400000000000002 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92000000000000004 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 1.71 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 2.8500000000000001 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 2.1000000000000001 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 4.1699999999999999 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 1.52 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 5.4900000000000002 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 2.5 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 3.6899999999999999 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 1.8799999999999999 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 7.0 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 4.2199999999999998 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 2.0099999999999998 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.3899999999999999 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 1.6200000000000001 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 0.58999999999999997 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 1.1699999999999999 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 2.2799999999999998 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 2.5600000000000001 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.411 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 3.6400000000000001 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 3.4700000000000002 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 3.8799999999999999 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 1.9399999999999999 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 2.3700000000000001 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 2.5 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.5800000000000001 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 2.5899999999999999 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 1.8999999999999999 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.4099999999999999 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 1.6599999999999999 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 2.3700000000000001 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 2.48 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 3.4399999999999999 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.5800000000000001 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 1.3700000000000001 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 1.6000000000000001 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 6.7400000000000002 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 1.4299999999999999 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 0.95999999999999996 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.55 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.9399999999999999 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 1.74 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.6100000000000001 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 2.5099999999999998 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.29 113.271 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 2.96 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.0899999999999999 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.3399999999999999 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 1.8200000000000001 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.6400000000000001 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.1699999999999999 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 1.5800000000000001 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 1.9399999999999999 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 8.4299999999999997 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.3200000000000001 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.56 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 1.3999999999999999 113.038 -173.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.1299999999999999 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.72 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.0899999999999999 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.56 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 3.1000000000000001 114.782 179.03 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.6499999999999999 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 5.3399999999999999 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.9100000000000001 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 5.7400000000000002 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.5900000000000001 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 1.8899999999999999 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 3.02 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 2.9300000000000002 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 6.0300000000000002 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 1.47 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 6.2800000000000002 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 2.3700000000000001 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 3.1499999999999999 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 1.76 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.0199999999999996 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 4.4100000000000001 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 2.0499999999999998 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.85999999999999999 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.9299999999999999 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.3100000000000001 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 0.85999999999999999 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 0.76000000000000001 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 2.3300000000000001 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.5700000000000001 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 3.8900000000000001 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.5099999999999998 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 2.21 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.6099999999999999 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 2.23 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 2.6800000000000002 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.47 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 2.2200000000000002 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 1.01 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.3300000000000001 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 1.53 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 1.52 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 3.3799999999999999 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.7999999999999998 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.2599999999999998 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.0 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 1.1899999999999999 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 6.4699999999999998 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 1.21 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 1.1899999999999999 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 1.99 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.4399999999999999 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 2.48 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 121.651 0.738 . . . . 1.3700000000000001 112.039 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 2.6400000000000001 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.2000000000000002 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.5099999999999998 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 1.78 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.5699999999999998 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 1.0700000000000001 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 1.6200000000000001 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 1.26 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 4.5700000000000003 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.3300000000000001 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.53 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.0600000000000001 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.8700000000000001 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.6599999999999999 113.823 -161.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 3.9399999999999999 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 3.0699999999999998 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.2799999999999998 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 5.4699999999999998 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.5499999999999998 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 5.3899999999999997 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.0700000000000001 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 2.7999999999999998 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.2799999999999998 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 2.0899999999999999 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 5.7800000000000002 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 1.2 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 6.2800000000000002 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 2.1499999999999999 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 2.9300000000000002 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.05 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.46 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.1399999999999997 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 3.7200000000000002 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 2.0 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.82999999999999996 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.4399999999999999 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.1699999999999999 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 0.53000000000000003 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 0.60999999999999999 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 3.0299999999999998 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.1600000000000001 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 2.9500000000000002 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 3.3799999999999999 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 2.1499999999999999 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.3300000000000001 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.4099999999999999 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.1200000000000001 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 2.2999999999999998 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.8300000000000001 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 2.1899999999999999 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 0.95999999999999996 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.90000000000000002 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 1.1499999999999999 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.28 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 1.3300000000000001 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 75' ' ' GLU . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.6899999999999999 109.39 173.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 4.3899999999999997 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 72' ' ' GLU . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 0.81999999999999995 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 0.88 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.1399999999999997 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 1.04 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 0.93999999999999995 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.1200000000000001 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 1.6200000000000001 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 1.3100000000000001 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.3500000000000001 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 3.1000000000000001 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 112.727 0.64 . . . . 1.1200000000000001 112.727 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 2.7000000000000002 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.0800000000000001 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 2.2000000000000002 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 1.7 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.8899999999999997 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 1.4099999999999999 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 1.74 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 1.8200000000000001 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.2800000000000002 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.51 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.486 HD23 ' CE1' ' A' ' 32' ' ' TYR . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 1.46 111.972 -177.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.6099999999999999 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.5299999999999998 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.6599999999999999 111.831 -161.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 3.6200000000000001 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 3.2400000000000002 115.359 174.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.4100000000000001 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 5.9800000000000004 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.8700000000000001 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 7.2800000000000002 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.5900000000000001 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.02 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.0699999999999998 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 2.8799999999999999 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 4.2599999999999998 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 1.3700000000000001 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.0099999999999998 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 2.1000000000000001 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.485 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.0899999999999999 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.4299999999999999 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 3.96 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 4.9100000000000001 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 1.9099999999999999 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.75 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 3.2599999999999998 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.4099999999999999 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 0.63 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 0.57999999999999996 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 4.5199999999999996 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.47 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 3.46 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.1899999999999999 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 1.99 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.5899999999999999 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.4399999999999999 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 2.3799999999999999 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 2.7999999999999998 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.6599999999999999 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 2.4199999999999999 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 1.05 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.1399999999999999 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 1.3899999999999999 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 1.6499999999999999 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 1.52 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.9900000000000002 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 3.6400000000000001 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.5499999999999998 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.3900000000000001 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.01 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.415 ' CD2' ' HD3' ' A' ' 84' ' ' PRO . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.1499999999999999 111.923 170.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.3399999999999999 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 1.3799999999999999 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 1.3799999999999999 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.4199999999999999 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 1.75 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 77' ' ' LEU . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 2.8399999999999999 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m . . . . . 0 CA--C 1.544 0.715 0 CA-C-O 120.813 0.339 . . . . 1.1899999999999999 111.491 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 2.3100000000000001 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.3900000000000001 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.6800000000000002 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 1.74 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 0.94999999999999996 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.3400000000000001 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 1.26 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 4.6600000000000001 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1000000000000001 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 1.45 112.846 -178.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.6699999999999999 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.1099999999999999 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 3.4300000000000002 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 2.6200000000000001 114.93 -177.328 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.3999999999999999 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 5.7400000000000002 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 6.5 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 1.99 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.1499999999999999 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 2.9100000000000001 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 4.1900000000000004 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 1.0600000000000001 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 4.6600000000000001 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 2.1499999999999999 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 4.6200000000000001 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.0600000000000001 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 1.9199999999999999 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 6.8399999999999999 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 4.8700000000000001 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 2.1499999999999999 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.92000000000000004 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.8700000000000001 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 1.5800000000000001 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 0.76000000000000001 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 0.79000000000000004 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 2.4300000000000002 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.53 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.434 HH22 ' CD ' ' A' ' 72' ' ' GLU . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 4.04 112.821 163.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 2.6699999999999999 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 2.1200000000000001 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.4399999999999999 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 2.3199999999999998 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.0600000000000001 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 1.78 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 1.8799999999999999 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 1.2 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.1399999999999999 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 1.3 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 1.25 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 1.46 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.434 ' CD ' HH22 ' A' ' 58' ' ' ARG . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.3100000000000001 108.669 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 3.5499999999999998 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 0.77000000000000002 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 0.81999999999999995 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 5.5300000000000002 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.93000000000000005 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 0.85999999999999999 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.25 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 1.1899999999999999 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 2.8199999999999998 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.545 0.763 0 CA-C-O 120.929 0.395 . . . . 1.23 111.669 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 2.8199999999999998 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.0899999999999999 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 1.8200000000000001 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.6499999999999999 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.1200000000000001 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.6499999999999999 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 1.26 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 6.6500000000000004 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.1899999999999999 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 1.3400000000000001 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.2999999999999998 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.5999999999999996 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.46 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.0 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 3.6800000000000002 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.3399999999999999 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 5.8899999999999997 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 3.7999999999999998 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89000000000000001 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 1.8500000000000001 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 2.46 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 2.1000000000000001 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 5.25 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 1.1000000000000001 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 4.6699999999999999 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 2.1200000000000001 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 4.6399999999999997 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.1899999999999999 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 1.47 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 4.21 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 4.7400000000000002 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 2.0699999999999998 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.73999999999999999 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.4099999999999999 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.1799999999999999 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 0.45000000000000001 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 0.59999999999999998 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 1.9199999999999999 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.72 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 72' ' ' GLU . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 4.2699999999999996 112.64 167.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 3.21 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 1.8899999999999999 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.0499999999999998 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.4299999999999999 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.467 HG13 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.1899999999999999 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.467 ' H ' HG13 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.0 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.6599999999999999 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 2.1000000000000001 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 0.93000000000000005 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 1.55 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 1.5600000000000001 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 1.6699999999999999 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 58' ' ' ARG . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.2799999999999998 109.276 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 5.5499999999999998 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.1800000000000002 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.2400000000000002 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 0.93000000000000005 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 0.87 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 5.5199999999999996 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 1.3700000000000001 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 1.02 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.0700000000000001 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 2.4700000000000002 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 1.3100000000000001 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.0900000000000001 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 2.7999999999999998 112.285 177.72 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 117.951 -1.024 . . . . 5.6200000000000001 109.139 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -75.8 169.01 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.347 2.698 . . . . 2.6800000000000002 113.203 -172.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -119.27 86.41 2.55 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.298 1.039 . . . . 1.98 111.213 174.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.16 -20.72 64.42 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.924 1.083 . . . . 2.52 113.924 -168.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -64.92 -45.45 85.79 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.66 1.184 . . . . 3.3799999999999999 112.831 173.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -80.31 -27.35 38.45 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.887 0.475 . . . . 2.6299999999999999 110.345 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.6 m -63.03 -53.33 55.54 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.719 0.691 . . . . 2.29 112.284 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.03 -47.43 83.09 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.115 0.87 . . . . 3.2200000000000002 111.321 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.74 -34.76 76.16 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.971 0.73 . . . . 1.45 112.971 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.5 p -65.47 -43.15 91.17 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.024 -1.048 . . . . 2.1200000000000001 111.809 170.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 90.0 m -60.48 -43.07 97.33 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 119.308 0.958 . . . . 1.55 111.359 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -45.09 92.03 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.351 1.061 . . . . 5.8600000000000003 111.738 173.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -58.68 -52.46 65.59 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 118.915 0.78 . . . . 1.6200000000000001 111.345 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.0 mp -66.72 -39.39 87.98 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.113 0.965 . . . . 1.5900000000000001 112.626 -172.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -57.46 -45.38 84.85 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.137 1.375 . . . . 2.9399999999999999 112.484 166.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.8 -40.46 92.77 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.782 1.174 . . . . 3.4199999999999999 113.502 175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.2 93.83 3.14 Favored 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.167 1.173 . . . . 1.98 114.167 -169.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.1 m-20 50.38 23.62 1.3 Allowed 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 127.944 2.498 . . . . 3.9500000000000002 116.973 161.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 48.74 45.59 21.81 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.483 1.113 . . . . 2.7999999999999998 111.969 -166.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -82.01 58.81 4.08 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-O 123.964 1.84 . . . . 2.2599999999999998 112.521 -174.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 ptt85 -51.03 -22.5 2.37 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 128.882 2.873 . . . . 5.2300000000000004 115.175 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -86.66 -34.03 19.91 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.939 0.895 . . . . 4.7000000000000002 112.87 171.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -78.95 -13.56 59.72 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.974 -1.704 . . . . 4.1200000000000001 113.331 174.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 2.3 m -109.19 25.09 12.2 Favored 'General case' 0 CA--C 1.557 1.231 0 N-CA-C 114.318 1.229 . . . . 1.05 114.318 162.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -51.24 -29.81 15.57 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 115.383 1.623 . . . . 1.8500000000000001 115.383 172.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.9 m -59.32 -33.43 71.1 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.732 1.213 . . . . 2.4300000000000002 112.152 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.94 -45.68 73.6 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.95 0.9 . . . . 2.1099999999999999 110.616 177.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -65.88 -32.07 73.37 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.673 -0.642 . . . . 5.5499999999999998 111.998 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.2 tp -62.4 -51.79 66.17 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.672 0.789 . . . . 1.26 112.43 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 37.1 mtm-85 -61.33 -28.47 69.24 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.48 -0.763 . . . . 4.5899999999999999 112.908 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.55 -45.16 69.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 118.698 -0.668 . . . . 2.6499999999999999 110.484 173.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -63.89 -35.12 79.6 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 119.908 1.231 . . . . 2.7599999999999998 113.767 171.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -63.81 -44.8 92.19 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.168 0.895 . . . . 1.55 110.717 172.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.09 -45.22 95.61 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 1.99 111.692 175.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.3 mtm180 -57.2 -48.7 78.11 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.764 0.826 . . . . 4.5999999999999996 111.639 173.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.1 ttm105 -61.44 -43.9 98.06 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.093 1.357 . . . . 3.6400000000000001 112.265 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -59.41 -54.56 45.27 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.335 0.654 . . . . 2.04 111.769 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.7 m95 -68.24 -31.32 70.73 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-O 118.793 -0.622 . . . . 1.02 112.277 -177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -63.52 -32.84 74.41 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 119.688 1.131 . . . . 1.5700000000000001 112.962 166.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.5 t -65.69 -46.01 80.66 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.938 -1.101 . . . . 2.5600000000000001 110.899 173.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.8 mm -63.0 -43.58 99.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 124.794 1.238 . . . . 0.51000000000000001 111.049 176.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -54.07 -50.53 53.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.406 1.083 . . . . 0.70999999999999996 110.69 172.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 84.2 mmm -65.98 -33.49 75.94 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.816 1.043 . . . . 3.21 113.816 177.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -73.76 -20.58 60.45 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.803 0.841 . . . . 1.4099999999999999 112.299 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.4 mtt85 -88.37 -33.08 18.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.985 1.314 . . . . 2.3599999999999999 113.019 169.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.8 ttt180 -70.74 -17.11 62.81 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.371 1.068 . . . . 3.0299999999999998 113.452 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 pttt -57.07 -21.99 35.88 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.329 1.603 . . . . 1.8700000000000001 115.329 170.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -99.05 -26.17 14.31 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 113.6 0.963 . . . . 2.3599999999999999 113.6 168.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.45 20.02 79.78 Favored Glycine 0 CA--C 1.538 1.499 0 N-CA-C 116.26 1.264 . . . . 1.5600000000000001 116.26 169.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 15.0 p -119.79 -31.85 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 115.295 1.591 . . . . 2.3300000000000001 115.295 -160.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.9 ptpt -101.03 167.36 10.86 Favored Pre-proline 0 N--CA 1.483 1.178 0 C-N-CA 125.212 1.405 . . . . 3.29 112.818 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -58.52 119.0 5.98 Favored 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 121.409 1.406 . . . . 2.0899999999999999 110.141 158.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.8 m-85 -76.73 -43.19 38.3 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 125.187 1.395 . . . . 2.21 113.741 -169.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.7 mmt -59.18 112.29 4.92 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.282 1.033 . . . . 1.5800000000000001 109.289 171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -66.04 137.67 49.35 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.818 2.345 . . . . 1.8799999999999999 112.173 -166.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 66.4 p -77.6 168.45 19.96 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 124.717 1.207 . . . . 2.3500000000000001 111.561 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 -40.98 64.16 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 114.891 1.441 . . . . 2.48 114.891 -168.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.92 -28.43 60.61 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.208 0.818 . . . . 2.3999999999999999 113.208 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.32 -50.24 48.34 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 123.763 0.825 . . . . 3.1400000000000001 109.304 170.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -53.59 -42.65 67.85 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.69 -0.631 . . . . 5.4699999999999998 111.345 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -60.75 -56.03 26.11 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.597 0.962 . . . . 2.6600000000000001 113.597 174.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -67.75 -29.36 68.56 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 113.071 0.767 . . . . 3.6499999999999999 113.071 -177.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 58.7 mt -74.36 -45.75 45.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 124.848 1.259 . . . . 1.1100000000000001 110.293 175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.1 mt -58.51 -35.34 72.1 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 119.528 1.058 . . . . 1.3500000000000001 111.913 171.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.8 mtt-85 -64.68 -39.33 93.48 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 118.247 -0.882 . . . . 5.3200000000000003 111.964 172.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.1 -17.72 56.59 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 115.063 1.505 . . . . 1.1100000000000001 115.063 178.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 95.4 t -79.21 -40.34 21.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.426 1.09 . . . . 0.88 110.035 163.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 72.88 11.93 78.54 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.48 1.038 . . . . 1.4399999999999999 113.467 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -157.22 172.67 18.21 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.947 2.099 . . . . 2.2999999999999998 109.872 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -72.72 132.14 83.58 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 125.285 1.434 . . . . 1.46 110.144 172.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -78.77 -2.44 12.45 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.541 2.161 . . . . 1.26 112.975 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.6 m-30 . . . . . 0 C--O 1.253 1.288 0 C-N-CA 126.607 1.963 . . . . 2.3999999999999999 110.714 -175.473 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.231 -0.89 . . . . 3.2799999999999998 109.682 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -82.61 158.62 16.58 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.388 2.725 . . . . 1.51 112.622 -178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.7 m -97.54 68.35 2.13 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.122 -0.986 . . . . 1.24 111.869 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.71 -33.66 71.1 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.275 0.843 . . . . 3.3100000000000001 113.275 -174.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.8 m -68.29 -39.96 81.94 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 120.998 -1.063 . . . . 2.5600000000000001 112.08 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -66.35 -31.29 71.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.549 1.14 . . . . 2.3999999999999999 110.815 171.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -70.48 -34.74 72.72 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.262 0.625 . . . . 1.6499999999999999 111.737 175.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -68.17 -36.89 80.33 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 120.476 -1.39 . . . . 2.5699999999999998 112.092 166.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.08 -37.14 86.37 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 120.266 1.394 . . . . 1.3300000000000001 111.656 174.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 t -62.78 -43.55 98.51 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.695 0.798 . . . . 1.51 111.716 167.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -60.46 -39.01 86.0 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.112 -0.993 . . . . 1.3600000000000001 111.404 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.96 -40.98 97.64 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.858 1.263 . . . . 5.7599999999999998 112.287 171.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 28.2 t -59.49 -46.89 87.52 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.896 1.226 . . . . 1.51 112.092 170.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.85 -38.61 91.56 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 120.833 -1.167 . . . . 1.76 112.423 -178.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.49 -27.21 65.93 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.69 1.596 . . . . 3.4199999999999999 114.064 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -66.1 -51.51 57.4 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.578 -1.326 . . . . 4.5499999999999998 113.095 166.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.19 78.61 1.66 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.179 1.392 . . . . 1.76 112.49 -168.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 35.7 t30 33.08 49.92 0.21 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 128.475 2.71 . . . . 2.8799999999999999 115.931 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 54.86 40.29 31.9 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.976 1.711 . . . . 3.2799999999999998 114.817 -178.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -79.86 63.29 4.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 123.583 1.659 . . . . 2.2599999999999998 113.362 -176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 12.1 ptm180 -53.94 -17.46 2.55 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 127.81 2.444 . . . . 4.9800000000000004 114.558 174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -85.97 -48.21 8.9 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.445 1.098 . . . . 2.9100000000000001 112.791 172.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -37.09 83.91 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 120.333 1.424 . . . . 3.6899999999999999 112.851 173.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.3 m -95.98 23.53 6.32 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.528 1.131 . . . . 1.02 113.945 173.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.6 m -59.38 -20.86 58.12 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.688 -1.258 . . . . 2.3700000000000001 113.57 168.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.7 p -50.73 -40.54 54.67 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.191 1.396 . . . . 2.0299999999999998 112.829 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -67.74 -44.33 77.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.104 0.962 . . . . 2.3399999999999999 112.056 177.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -72.6 -29.98 63.97 Favored 'General case' 0 CA--C 1.542 0.671 0 O-C-N 121.495 -0.753 . . . . 6.0999999999999996 112.27 -179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.5 tp -63.53 -49.02 75.15 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.786 1.234 . . . . 1.3500000000000001 111.789 164.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 39.1 mtp-105 -61.26 -27.18 68.28 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 120.826 -1.171 . . . . 4.46 112.529 174.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -71.9 -40.68 68.67 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.185 0.594 . . . . 2.4300000000000002 111.708 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -55.46 -41.29 72.71 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 119.629 1.104 . . . . 4.6699999999999999 110.911 165.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 -66.78 -37.56 84.83 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 118.949 -0.548 . . . . 1.3400000000000001 111.893 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.9 m -57.8 -50.35 73.58 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.159 0.89 . . . . 1.7 110.956 171.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -60.54 -51.95 67.25 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.398 1.079 . . . . 4.1600000000000001 110.921 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -56.64 -45.27 81.69 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.024 1.33 . . . . 5.6200000000000001 112.209 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -59.39 -58.72 7.37 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 118.614 0.643 . . . . 1.8899999999999999 111.227 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -68.13 -32.86 73.44 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.73 0.641 . . . . 1.02 112.73 -175.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -62.14 -35.32 78.41 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.269 1.028 . . . . 1.5 112.349 167.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.7 m -74.21 -33.34 63.37 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.817 -1.177 . . . . 1.3600000000000001 112.794 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.86 -42.53 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 119.287 0.949 . . . . 0.57999999999999996 110.253 168.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.55 -47.59 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 123.735 0.814 . . . . 0.73999999999999999 111.142 172.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.2 mmt -60.08 -38.12 81.97 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 119.854 1.206 . . . . 1.8300000000000001 113.266 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -74.54 -27.98 60.76 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.84 0.856 . . . . 2.3999999999999999 112.803 -178.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 46.4 mtp85 -90.15 -20.49 23.03 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.695 1.198 . . . . 2.6299999999999999 113.061 174.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.1 ttt180 -73.22 -17.0 61.4 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.284 1.433 . . . . 2.8500000000000001 113.683 174.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -54.21 -29.16 45.22 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 113.943 1.09 . . . . 2.4199999999999999 113.943 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -99.0 -9.06 24.46 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.074 1.509 . . . . 2.46 115.074 174.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.47 4.17 60.04 Favored Glycine 0 CA--C 1.541 1.68 0 N-CA-C 117.74 1.856 . . . . 1.5 117.74 165.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -110.12 -25.26 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 116.168 1.914 . . . . 2.1000000000000001 116.168 -149.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -129.43 173.76 5.34 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 127.095 2.158 . . . . 2.6099999999999999 111.756 -172.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -62.24 117.6 4.46 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 CA-C-N 120.738 1.299 . . . . 1.54 111.176 166.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -74.96 -40.98 60.46 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.273 1.029 . . . . 2.6000000000000001 112.963 -172.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.5 mmt -56.64 109.31 1.61 Allowed Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 123.849 0.86 . . . . 1.0700000000000001 109.503 164.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -69.0 148.32 69.75 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 123.168 2.578 . . . . 1.0700000000000001 112.679 -166.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 62.7 p -80.35 166.8 20.96 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.284 1.434 . . . . 1.3799999999999999 111.331 172.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.12 -34.34 68.27 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.769 1.396 . . . . 1.74 114.769 -167.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.65 -33.86 64.69 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.441 -0.787 . . . . 1.6699999999999999 113.053 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -69.83 -49.39 53.03 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.646 1.578 . . . . 2.6200000000000001 108.118 175.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -51.9 -44.32 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.542 1.137 . . . . 3.73 112.237 171.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -60.37 -54.95 39.54 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.4 0.68 . . . . 2.3799999999999999 112.709 175.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.38 -27.9 68.89 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.636 0.976 . . . . 2.5800000000000001 113.636 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 45.3 mt -73.39 -46.26 49.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 124.983 1.313 . . . . 0.96999999999999997 110.26 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.65 -31.32 71.41 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.223 -0.923 . . . . 1.0800000000000001 112.667 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 42.8 mtp180 -73.16 -30.6 63.69 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.329 1.052 . . . . 4.6200000000000001 113.005 171.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.44 -30.79 62.03 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.317 1.047 . . . . 0.97999999999999998 112.934 174.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.9 t -71.76 -39.88 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.495 -0.753 . . . . 0.94999999999999996 109.665 162.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.89 4.9 68.24 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.876 1.703 . . . . 1.23 113.13 -178.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -161.43 170.6 19.71 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.859 2.064 . . . . 2.6099999999999999 110.818 -173.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.77 128.52 92.91 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.969 1.308 . . . . 1.6599999999999999 110.806 176.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -73.19 -6.24 18.57 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 122.01 1.807 . . . . 1.3500000000000001 112.701 171.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 126.989 2.116 . . . . 2.48 113.017 -179.733 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 . . . . . 0 N--CA 1.476 0.856 0 CA-C-O 117.95 -1.024 . . . . 4.54 109.693 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -78.82 128.07 8.26 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.131 2.554 . . . . 2.4900000000000002 109.956 166.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.0 m -99.15 84.45 3.04 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.041 -1.037 . . . . 1.5900000000000001 112.221 -174.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.31 -32.24 71.24 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 113.83 1.048 . . . . 3.8500000000000001 113.83 -171.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.8 m -72.36 -44.68 62.22 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 118.851 0.751 . . . . 2.1899999999999999 111.517 175.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -60.96 -37.07 81.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.405 0.682 . . . . 2.4900000000000002 110.367 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.0 m -66.47 -46.9 74.82 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.625 -0.716 . . . . 1.55 111.778 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -63.51 -41.76 98.5 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 122.948 0.499 . . . . 2.7200000000000002 111.386 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.92 86.58 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.183 0.993 . . . . 1.0600000000000001 112.665 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.1 t -58.15 -50.87 72.0 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.265 0.626 . . . . 1.6699999999999999 111.812 164.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -63.65 -32.68 74.23 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.546 -1.346 . . . . 1.4099999999999999 112.597 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.36 -43.54 85.71 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.872 1.269 . . . . 4.6100000000000003 111.377 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.2 t -57.38 -46.83 82.99 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.78 0.718 . . . . 1.26 111.003 172.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -66.82 -34.58 78.12 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 125.234 1.414 . . . . 1.4299999999999999 113.468 -178.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -66.36 -38.98 88.84 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.861 0.864 . . . . 2.9199999999999999 111.724 167.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -48.2 78.46 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.484 1.514 . . . . 3.1200000000000001 113.011 176.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -126.29 64.96 1.24 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.781 1.633 . . . . 1.49 112.659 -170.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 64.6 t30 33.1 56.02 0.46 Allowed 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 127.609 2.364 . . . . 3.2200000000000002 115.817 172.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.419 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 59.33 33.1 22.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 126.266 1.827 . . . . 3.0499999999999998 115.847 174.36 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -76.33 66.79 2.47 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 124.171 1.938 . . . . 2.2000000000000002 112.982 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.8 ptm180 -50.65 -21.69 1.7 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.405 2.682 . . . . 4.8700000000000001 114.22 174.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -80.67 -50.8 9.45 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.129 1.372 . . . . 2.7799999999999998 110.893 173.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 30.7 mmt-85 -63.57 -18.93 64.39 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.243 1.201 . . . . 4.2800000000000002 114.243 174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.9 m -114.07 22.96 13.37 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.214 1.561 . . . . 0.88 115.214 167.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.8 t -55.47 -31.57 62.09 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 120.634 -1.291 . . . . 2.3599999999999999 113.839 178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.0 m -60.39 -25.79 66.16 Favored 'General case' 0 N--CA 1.475 0.802 0 O-C-N 121.181 -0.95 . . . . 3.29 112.594 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -71.56 -44.23 64.92 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 120.265 -1.522 . . . . 2.0699999999999998 111.766 174.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -66.27 -32.39 73.77 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 121.828 -0.545 . . . . 6.0800000000000001 112.087 175.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 6.3 tp -61.72 -48.94 78.49 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.825 1.25 . . . . 1.28 112.574 166.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 42.0 mtp85 -61.96 -30.81 71.18 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.342 -0.849 . . . . 4.6500000000000004 111.861 176.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -70.46 -38.9 74.52 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 117.837 0.29 . . . . 2.7599999999999998 111.164 172.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.7 ttmm -63.2 -34.92 78.68 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.2 -0.938 . . . . 3.8999999999999999 112.103 171.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -63.67 -34.98 79.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.917 0.887 . . . . 1.6499999999999999 111.023 172.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 58.8 m -66.85 -20.78 65.99 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.593 1.331 . . . . 2.29 114.593 174.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -85.56 -54.55 4.49 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.229 1.012 . . . . 5.7000000000000002 111.869 164.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.3 ttm-85 -59.65 -40.67 88.5 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 5.3899999999999997 113.095 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.3 t80 -61.71 -52.89 62.43 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.525 1.057 . . . . 1.96 110.639 178.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 99.9 m95 -72.63 -28.66 62.89 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.644 -0.707 . . . . 0.81999999999999995 112.127 -173.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -63.62 -36.23 83.14 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.228 1.011 . . . . 2.2999999999999998 112.899 165.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.5 m -67.61 -38.6 84.18 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.016 0.526 . . . . 1.3999999999999999 111.296 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 48.8 mm -62.78 -43.03 98.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-N 119.044 0.838 . . . . 0.59999999999999998 111.029 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -56.24 -49.73 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.918 0.887 . . . . 0.87 111.194 174.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.6 mmt -62.28 -36.27 81.57 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.239 0.927 . . . . 2.04 113.15 176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -74.89 -18.03 60.48 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.92 1.288 . . . . 2.0499999999999998 112.926 177.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -92.54 -29.35 16.23 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.09 1.356 . . . . 3.8300000000000001 113.584 169.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -74.65 -19.49 60.26 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.535 0.939 . . . . 2.6899999999999999 113.535 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -55.71 -27.28 49.57 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.249 1.574 . . . . 1.95 115.249 171.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -103.61 -12.85 16.8 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.55 0.945 . . . . 2.5699999999999998 113.55 172.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.63 8.32 76.32 Favored Glycine 0 CA--C 1.54 1.61 0 N-CA-C 116.899 1.52 . . . . 1.54 116.899 165.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.8 p -114.33 -17.48 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.144 0 N-CA-C 115.451 1.649 . . . . 2.5299999999999998 115.451 -151.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -132.89 173.47 5.85 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 126.768 2.027 . . . . 2.3199999999999998 112.848 -164.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -60.42 108.45 0.52 Allowed 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 121.402 1.401 . . . . 1.98 111.306 160.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -68.25 -44.25 76.04 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.718 1.607 . . . . 2.4399999999999999 112.222 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.8 mmt -67.6 110.18 4.95 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.804 0.841 . . . . 1.1499999999999999 109.589 162.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.26 145.78 55.2 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.158 2.572 . . . . 0.94999999999999996 112.59 -174.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 81.1 p -77.95 168.22 20.25 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.169 1.388 . . . . 1.1100000000000001 111.833 175.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.56 -46.38 70.24 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.463 1.283 . . . . 1.3899999999999999 114.463 -168.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.47 -23.59 61.06 Favored 'General case' 0 CA--C 1.546 0.824 0 O-C-N 121.36 -0.837 . . . . 1.52 113.217 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -73.55 -49.64 25.4 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.446 1.098 . . . . 2.2000000000000002 109.168 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.9 mtp-105 -51.79 -39.51 58.79 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 118.393 0.542 . . . . 3.6000000000000001 111.415 171.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -62.98 -54.61 35.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.69 0.796 . . . . 2.8799999999999999 112.591 174.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.7 -26.89 68.57 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.224 1.375 . . . . 2.21 113.556 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.7 mt -75.49 -50.68 23.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.731 1.612 . . . . 0.71999999999999997 110.249 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 50.3 mt -59.61 -32.26 70.25 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.117 -0.989 . . . . 0.91000000000000003 112.386 173.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -77.76 -29.99 51.27 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.148 0.979 . . . . 3.9399999999999999 112.317 175.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.23 -34.08 72.45 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.01 0.744 . . . . 0.98999999999999999 113.01 171.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.9 t -68.26 -44.98 83.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 N-CA-C 108.568 -0.901 . . . . 0.84999999999999998 108.568 165.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 83.62 3.34 89.7 Favored Glycine 0 CA--C 1.531 1.04 0 C-N-CA 126.019 1.771 . . . . 1.2 114.15 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -155.74 163.64 39.61 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 126.148 1.779 . . . . 2.4199999999999999 109.099 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -63.89 119.78 57.88 Favored Pre-proline 0 CA--C 1.543 0.708 0 C-N-CA 124.353 1.061 . . . . 1.48 109.15 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.48 -0.81 9.78 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 123.104 2.536 . . . . 1.1299999999999999 112.634 -177.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.1 m-30 . . . . . 0 C--O 1.249 1.072 0 C-N-CA 126.143 1.777 . . . . 2.9300000000000002 109.58 -179.608 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 118.835 -0.602 . . . . 3.6299999999999999 110.073 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -73.98 169.02 23.37 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 124.008 3.139 . . . . 2.1000000000000001 111.329 170.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 3.0 m -94.97 82.01 3.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.394 0.886 . . . . 1.6699999999999999 113.394 -177.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.2 mp -64.61 -26.57 68.46 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.049 1.34 . . . . 3.9199999999999999 113.535 -174.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.0 m -71.27 -40.78 70.74 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.618 0.767 . . . . 2.2599999999999998 111.998 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -67.93 -34.13 76.02 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.114 0.965 . . . . 2.7200000000000002 110.455 174.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.1 m -63.8 -38.26 90.43 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.058 0.543 . . . . 2.2400000000000002 112.129 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.79 -47.7 79.83 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 118.743 0.701 . . . . 3.1499999999999999 111.481 176.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.11 -38.8 72.32 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.514 -0.742 . . . . 1.0700000000000001 112.943 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.1 t -48.94 -49.28 41.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.742 1.217 . . . . 1.3200000000000001 110.989 163.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 45.5 m -64.73 -34.45 78.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 118.236 -0.887 . . . . 1.6599999999999999 111.866 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.3 mmt180 -68.41 -36.25 78.84 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 120.701 1.591 . . . . 4.8799999999999999 112.725 175.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.0 t -60.82 -51.46 69.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.82 0.737 . . . . 1.6399999999999999 111.579 168.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 mp -67.73 -22.53 65.23 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 125.472 1.509 . . . . 2.7200000000000002 114.959 -177.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -75.62 -36.0 60.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.844 2.058 . . . . 3.1699999999999999 112.848 164.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -70.1 -36.99 75.26 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.404 1.631 . . . . 4.0 115.404 173.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -137.76 155.2 49.31 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.391 1.476 . . . . 3.8199999999999998 113.052 -173.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -62.86 79.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 126.853 2.061 . . . . 6.25 114.326 -174.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.255 3.8 t80 41.7 46.51 3.26 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.895 2.478 . . . . 4.0800000000000001 115.158 -172.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -80.57 53.98 1.98 Allowed 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.203 -1.561 . . . . 2.1899999999999999 113.22 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -68.29 6.56 0.75 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.075 1.35 . . . . 6.5700000000000003 113.073 171.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -89.6 -37.64 14.52 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.15 1.78 . . . . 3.4399999999999999 111.059 169.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -76.03 -36.21 59.2 Favored 'General case' 0 N--CA 1.483 1.195 0 O-C-N 121.226 -0.921 . . . . 4.5999999999999996 111.715 163.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 91.0 m -99.68 30.62 3.55 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.539 1.535 . . . . 1.0600000000000001 114.006 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.6 m -64.85 -29.06 70.0 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 120.492 -1.38 . . . . 1.8899999999999999 112.452 174.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.0 m -52.98 -34.38 55.77 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.409 1.084 . . . . 2.3599999999999999 113.536 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -69.85 -47.72 61.62 Favored 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.379 -0.826 . . . . 2.1200000000000001 111.65 176.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -58.15 -37.22 74.23 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.236 0.614 . . . . 5.2199999999999998 111.18 172.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.95 -53.17 50.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.955 0.902 . . . . 1.26 112.537 174.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -63.92 -24.83 67.88 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.904 1.229 . . . . 4.7400000000000002 112.379 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -74.99 -41.98 58.44 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.9 0.88 . . . . 2.1699999999999999 111.347 172.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -68.35 -35.65 78.08 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.333 1.053 . . . . 3.3100000000000001 112.331 174.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -61.28 -43.93 98.06 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.205 0.911 . . . . 1.4199999999999999 110.689 169.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 42.9 t -62.81 -47.46 83.35 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.724 1.21 . . . . 1.6599999999999999 111.196 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.95 -53.37 57.72 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 124.518 1.127 . . . . 3.75 111.69 171.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -61.92 -44.46 96.73 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.235 1.414 . . . . 4.75 112.284 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -56.79 -57.55 11.97 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.026 0.93 . . . . 2.4199999999999999 111.651 173.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -66.19 -28.61 68.89 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.043 0.386 . . . . 1.1000000000000001 112.043 -175.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -68.87 -33.75 74.31 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.626 1.171 . . . . 2.1400000000000001 112.935 168.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.2 m -65.95 -42.54 89.83 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.005 -1.06 . . . . 1.3799999999999999 111.694 168.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -59.78 -42.78 89.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-N 119.219 0.918 . . . . 0.81999999999999995 110.312 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.6 t -55.44 -48.45 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.879 0.871 . . . . 0.85999999999999999 111.626 171.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -62.51 -34.25 76.51 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.045 1.293 . . . . 1.8999999999999999 114.424 175.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 80.4 mm-40 -78.92 -19.96 50.52 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.739 0.816 . . . . 1.4099999999999999 113.068 177.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 49.3 mtp85 -89.72 -30.59 17.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.22 1.408 . . . . 2.3799999999999999 112.705 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 47.3 ttt180 -65.6 -16.27 63.54 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.457 1.503 . . . . 2.4100000000000001 113.758 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -51.86 -25.0 6.94 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.068 1.507 . . . . 2.75 115.068 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.0 m-80 -83.38 -24.99 31.77 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.639 1.176 . . . . 4.0800000000000001 113.331 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.84 15.39 69.02 Favored Glycine 0 CA--C 1.539 1.538 0 N-CA-C 116.339 1.296 . . . . 1.51 116.339 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 64' ' ' LYS . 7.4 p -135.97 -62.14 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 N-CA-C 114.708 1.373 . . . . 3.2400000000000002 114.708 -161.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' H ' HG13 ' A' ' 63' ' ' VAL . 2.1 ptpp? -62.98 163.77 15.41 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.375 1.47 . . . . 1.8799999999999999 112.818 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -58.66 117.1 3.77 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 N-CA-C 108.784 -1.275 . . . . 2.1099999999999999 108.784 157.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -73.63 -42.19 61.78 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.569 1.147 . . . . 2.29 111.725 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.06 108.17 1.25 Allowed Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.426 1.09 . . . . 1.45 109.63 164.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.65 136.29 38.68 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.546 2.164 . . . . 1.48 112.405 -167.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -70.66 167.81 17.84 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.439 1.096 . . . . 2.1699999999999999 110.905 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.91 -45.34 50.84 Favored 'General case' 0 CA--C 1.552 1.044 0 N-CA-C 115.454 1.65 . . . . 2.0800000000000001 115.454 -165.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -79.69 -21.97 44.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.985 1.106 . . . . 2.1800000000000002 113.985 178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -72.18 -52.84 14.67 Favored 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 125.103 1.361 . . . . 4.1200000000000001 107.951 171.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.8 ttt-85 -50.78 -40.47 55.24 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.822 1.649 . . . . 4.6200000000000001 111.114 171.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -67.8 -49.41 62.51 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.651 0.982 . . . . 3.3100000000000001 113.651 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -65.16 -26.96 68.39 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.214 0.915 . . . . 2.6899999999999999 113.095 176.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 32.7 mt -74.76 -45.92 42.86 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 125.102 1.361 . . . . 0.93999999999999995 109.994 177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.4 mt -58.75 -36.8 74.95 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.215 -0.928 . . . . 0.92000000000000004 111.88 170.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 87.2 mtt-85 -67.31 -35.04 78.62 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.04 0.936 . . . . 4.4699999999999998 111.784 172.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -30.26 66.79 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.859 0.864 . . . . 1.4299999999999999 113.322 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.85 -42.39 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 119.437 1.017 . . . . 1.4299999999999999 110.336 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.43 -3.48 62.86 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.757 1.646 . . . . 1.23 113.777 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -147.97 167.1 25.75 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.706 1.603 . . . . 2.6899999999999999 111.47 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.98 117.71 65.88 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.583 1.553 . . . . 1.8500000000000001 109.153 177.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.34 -2.81 13.01 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 121.798 1.666 . . . . 1.4199999999999999 113.469 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.635 1.974 . . . . 3.0699999999999998 111.703 -170.191 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.473 0.68 0 CA-C-O 118.433 -0.794 . . . . 3.8700000000000001 109.526 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -63.62 156.66 55.79 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 121.559 1.506 . . . . 1.75 109.935 150.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -119.4 103.52 9.54 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.602 0.761 . . . . 1.1399999999999999 112.115 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 -26.14 59.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.575 1.15 . . . . 2.52 113.663 -167.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.4 m -76.44 -44.97 33.49 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.956 -1.09 . . . . 2.0299999999999998 111.7 175.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.94 -36.09 82.28 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 110.05 -0.352 . . . . 2.73 110.05 172.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.0 m -66.66 -46.29 76.2 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.559 0.577 . . . . 1.7 112.559 178.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -61.04 -50.69 72.3 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.676 -0.64 . . . . 2.9399999999999999 111.695 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.24 -32.57 68.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.215 0.821 . . . . 0.97999999999999998 113.215 -175.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 28.8 p -66.89 -43.68 82.83 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.689 0.996 . . . . 1.74 113.689 166.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 57.0 m -58.31 -43.56 88.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.438 1.017 . . . . 1.29 110.464 175.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 37.2 mtp180 -63.3 -42.12 99.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.267 1.427 . . . . 6.0800000000000001 112.503 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.2 t -58.87 -49.79 76.42 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.383 0.992 . . . . 1.1000000000000001 111.974 171.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.8 mp -68.72 -28.06 66.49 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.002 -1.061 . . . . 1.4099999999999999 112.639 -175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -76.77 -29.59 56.16 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 126.368 1.867 . . . . 2.8500000000000001 114.625 166.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.5 -54.82 14.39 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.887 1.675 . . . . 3.1400000000000001 111.956 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.58 48.21 1.81 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.69 1.596 . . . . 1.5700000000000001 112.416 -165.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.2 t30 48.48 61.68 2.93 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.145 1.778 . . . . 3.3300000000000001 115.5 169.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.8 t80 60.34 45.88 10.68 Favored 'General case' 0 CA--C 1.55 0.943 0 N-CA-C 115.839 1.792 . . . . 5.54 115.839 173.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -82.45 55.94 3.1 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 123.653 1.692 . . . . 3.23 114.149 -174.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -15.22 54.07 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.993 2.117 . . . . 7.2000000000000002 116.47 -169.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -93.39 -20.12 20.65 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.882 1.273 . . . . 3.2400000000000002 112.855 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -91.27 -32.9 15.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.13 0.972 . . . . 3.6800000000000002 110.87 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.9 m -98.28 28.29 4.17 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 113.826 1.047 . . . . 0.93999999999999995 113.826 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -14.88 59.06 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 120.958 -1.089 . . . . 2.2000000000000002 112.979 173.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.8 p -47.34 -51.56 19.07 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.143 1.777 . . . . 2.29 112.545 169.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -58.53 -46.5 86.68 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.372 1.469 . . . . 2.1499999999999999 112.518 173.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -68.68 -27.12 65.69 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 123.643 0.777 . . . . 4.2400000000000002 112.204 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.7 -52.78 33.71 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.917 1.287 . . . . 1.1599999999999999 110.259 169.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 70.1 mtm-85 -58.84 -27.56 65.23 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.76 0.709 . . . . 4.6200000000000001 112.768 173.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -74.66 -41.94 59.39 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.233 1.013 . . . . 1.99 111.9 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -66.84 -33.94 76.7 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 120.651 -1.28 . . . . 2.6099999999999999 112.218 169.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 27.2 m-20 -61.57 -38.14 86.43 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.279 0.945 . . . . 1.1299999999999999 111.157 170.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 19.6 t -66.35 -28.68 68.85 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 125.621 1.568 . . . . 2.0800000000000001 113.432 177.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -70.68 -61.78 1.64 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.139 0.576 . . . . 4.4699999999999998 110.582 162.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 ttm105 -55.09 -41.61 71.79 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.664 1.185 . . . . 3.9500000000000002 113.597 -170.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -62.22 -54.92 33.98 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 123.561 0.744 . . . . 2.02 111.962 178.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -72.24 -30.0 64.46 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.789 -0.364 . . . . 0.68999999999999995 111.528 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -63.42 -35.31 79.99 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.741 1.216 . . . . 1.4199999999999999 112.954 166.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.8 t -64.51 -45.58 86.63 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.697 1.135 . . . . 2.5499999999999998 111.546 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -58.55 -40.81 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 119.067 0.849 . . . . 0.56000000000000005 110.888 176.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.2 t -59.66 -49.62 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.322 1.049 . . . . 0.59999999999999998 111.61 172.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.5 mmm -62.45 -38.67 90.67 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 119.721 1.146 . . . . 2.4300000000000002 113.108 179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -68.84 -40.95 79.15 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.829 -0.544 . . . . 1.48 111.095 176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.3 mtt85 -71.01 -28.4 64.38 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.683 -1.261 . . . . 2.4399999999999999 113.602 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.5 ttp180 -67.32 -17.59 64.83 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.583 1.553 . . . . 4.8600000000000003 113.449 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 52.3 pttt -47.42 -33.68 6.33 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.519 1.127 . . . . 2.8399999999999999 113.537 169.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -79.84 -29.5 40.14 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.284 0.634 . . . . 2.8999999999999999 112.617 -177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.35 15.58 77.11 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.525 1.536 . . . . 1.45 115.693 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -135.1 -49.32 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 114.973 1.471 . . . . 2.3300000000000001 114.973 -160.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.96 166.1 47.84 Favored Pre-proline 0 N--CA 1.48 1.039 0 C-N-CA 127.18 2.192 . . . . 2.3799999999999999 113.682 -177.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -63.36 126.91 18.69 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 121.043 1.162 . . . . 1.3100000000000001 109.384 156.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -82.71 -38.79 22.84 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.124 1.369 . . . . 1.98 111.545 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.5 mmt -64.29 113.37 10.18 Favored Pre-proline 0 CA--C 1.549 0.927 0 C-N-CA 124.803 1.241 . . . . 0.97999999999999998 110.438 166.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.37 152.6 49.7 Favored 'Trans proline' 0 CA--C 1.535 0.556 0 C-N-CA 123.843 3.028 . . . . 1.0800000000000001 114.192 -166.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 60.8 p -81.07 163.65 23.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.781 1.632 . . . . 1.3799999999999999 111.636 174.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.21 -46.77 46.21 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 115.095 1.517 . . . . 1.49 115.095 -168.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.99 -27.12 60.03 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 113.947 1.092 . . . . 1.5800000000000001 113.947 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.3 -54.47 14.47 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.197 1.399 . . . . 2.2000000000000002 108.374 171.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.31 -44.65 44.39 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.517 1.527 . . . . 4.71 111.563 174.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -65.2 -51.73 59.17 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.036 0.935 . . . . 2.2200000000000002 112.599 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -66.65 -24.77 66.34 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 120.845 -1.159 . . . . 2.2799999999999998 113.613 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -74.98 -45.03 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.501 1.52 . . . . 0.82999999999999996 110.313 175.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 21.4 mt -59.55 -33.92 72.01 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.68 -1.262 . . . . 1.01 112.361 169.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -71.99 -30.58 65.38 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.639 0.776 . . . . 4.1900000000000004 112.573 172.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.17 -25.26 62.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.463 1.105 . . . . 1.3300000000000001 113.761 170.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.7 t -69.71 -48.11 66.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 120.907 -1.12 . . . . 1.1399999999999999 109.399 162.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 78.59 6.85 88.25 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.332 0.968 . . . . 1.23 113.269 -175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -155.04 -173.06 4.41 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.393 1.877 . . . . 1.8200000000000001 109.199 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.94 119.69 76.76 Favored Pre-proline 0 CA--C 1.541 0.601 0 O-C-N 120.639 -1.288 . . . . 1.3500000000000001 109.001 168.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -73.4 -2.64 12.42 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.15 1.9 . . . . 1.0800000000000001 113.096 -176.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 C--O 1.256 1.399 0 C-N-CA 126.427 1.891 . . . . 3.1099999999999999 111.228 -176.592 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 118.953 -0.546 . . . . 4.25 111.31 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -64.43 148.2 90.7 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 124.238 3.292 . . . . 2.2400000000000002 112.817 176.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.8 m -90.17 64.16 6.03 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.337 1.055 . . . . 1.5 113.169 -170.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -50.21 -35.75 27.89 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.887 1.675 . . . . 2.96 113.153 179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.3 m -64.93 -36.55 84.75 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 125.584 1.554 . . . . 2.25 113.121 -177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -85.93 -25.87 25.85 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.524 0.73 . . . . 3.3100000000000001 111.091 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.73 -33.08 75.05 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 112.077 0.399 . . . . 1.8799999999999999 112.077 171.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -62.03 -46.69 88.07 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.232 1.813 . . . . 2.5899999999999999 111.817 169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.05 -38.81 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.562 -0.711 . . . . 1.25 112.308 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.9 t -57.59 -50.58 72.65 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.08 1.352 . . . . 1.51 112.515 167.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.5 m -59.03 -41.86 88.8 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.678 1.191 . . . . 1.5800000000000001 111.363 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.7 mtp180 -69.74 -38.41 76.81 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.126 1.37 . . . . 5.3899999999999997 112.96 176.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.5 t -56.99 -48.91 77.29 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 119.13 0.877 . . . . 1.3 111.181 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -63.07 -41.08 99.36 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 124.141 0.976 . . . . 1.6899999999999999 113.046 -178.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -61.84 -34.14 75.43 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 113.239 0.829 . . . . 3.5099999999999998 113.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -66.23 -52.11 50.97 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 120.002 1.274 . . . . 3.6800000000000002 114.205 173.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.32 68.95 1.01 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.69 1.196 . . . . 1.8400000000000001 113.651 -163.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.1 t30 44.94 41.38 5.23 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 115.226 1.565 . . . . 4.2000000000000002 115.226 167.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.424 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 53.26 38.65 28.22 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.09 1.756 . . . . 2.8599999999999999 115.553 -176.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -75.59 62.3 1.42 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.414 1.885 . . . . 2.6299999999999999 112.566 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -0.31 0.67 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.056 1.743 . . . . 6.5800000000000001 114.674 174.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -90.81 -36.83 14.01 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 119.834 1.197 . . . . 4.0 111.939 165.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 67.9 mtt85 -65.12 -28.46 69.44 Favored 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 119.473 1.033 . . . . 3.6499999999999999 113.097 163.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.93 25.9 10.78 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 115.073 1.508 . . . . 0.91000000000000003 115.073 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 1.9 t -69.29 -29.06 66.84 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.663 -1.273 . . . . 2.0699999999999998 112.915 173.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -54.82 -38.32 67.23 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.448 1.499 . . . . 3.1000000000000001 112.821 176.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -61.2 -46.35 90.84 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.6 1.16 . . . . 2.04 111.213 174.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -36.38 82.68 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.755 0.822 . . . . 4.0199999999999996 111.041 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 26.4 tp -64.14 -51.39 64.12 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.368 -0.833 . . . . 1.6299999999999999 112.144 171.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -59.06 -28.11 66.15 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.486 -0.759 . . . . 4.46 111.74 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -75.52 -43.06 50.95 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.057 1.343 . . . . 2.7599999999999998 112.209 172.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -61.89 -35.87 79.63 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.962 1.255 . . . . 3.52 111.397 172.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -61.85 -30.64 70.99 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.643 0.777 . . . . 1.8400000000000001 111.383 177.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 74.7 m -66.3 -29.9 70.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.846 0.748 . . . . 2.1899999999999999 112.667 175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -79.02 -56.45 4.38 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.924 -0.485 . . . . 5.1900000000000004 110.253 167.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -57.48 -39.0 75.45 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.088 1.355 . . . . 4.8399999999999999 113.763 -172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -63.63 -55.45 23.49 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.616 1.098 . . . . 2.1800000000000002 111.056 176.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -71.67 -30.72 66.03 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.717 -0.674 . . . . 1.0800000000000001 112.048 -174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -61.68 -39.8 92.73 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.52 1.528 . . . . 1.71 112.559 166.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.4 m -65.48 -41.28 93.46 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 121.366 -0.834 . . . . 1.5600000000000001 111.052 174.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.3 mm -61.84 -39.65 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 O-C-N 121.425 -0.797 . . . . 0.52000000000000002 111.306 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 19.9 t -58.54 -50.07 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.629 1.172 . . . . 0.68999999999999995 111.326 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 19.9 mmt -62.52 -39.6 94.07 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 119.464 1.029 . . . . 2.6800000000000002 112.557 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.2 mm-40 -69.5 -30.04 67.81 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.622 -0.673 . . . . 1.71 112.286 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 18.4 mtt85 -79.59 -26.19 41.34 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.144 1.377 . . . . 2.8900000000000001 113.549 171.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -69.44 -16.01 63.4 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.55 1.14 . . . . 2.5299999999999998 113.077 175.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -52.19 -30.62 27.92 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.304 1.224 . . . . 1.79 114.304 174.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -100.94 -14.4 17.91 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 114.632 1.345 . . . . 2.3500000000000001 114.632 177.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.15 19.75 77.53 Favored Glycine 0 CA--C 1.535 1.342 0 N-CA-C 116.535 1.374 . . . . 1.29 116.535 167.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -125.16 -43.09 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 CA-C-N 119.488 1.644 . . . . 1.8700000000000001 114.938 -164.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -83.75 165.46 39.55 Favored Pre-proline 0 N--CA 1.481 1.084 0 CA-C-N 119.49 1.041 . . . . 1.8999999999999999 113.246 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -58.4 113.72 1.67 Allowed 'Trans proline' 0 CA--C 1.536 0.613 0 N-CA-C 107.931 -1.604 . . . . 1.3600000000000001 107.931 153.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -70.96 -39.81 72.33 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 124.238 1.015 . . . . 1.98 111.784 -173.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 mmt -57.28 110.56 2.54 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.582 1.153 . . . . 1.1200000000000001 110.017 165.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -68.39 143.73 59.06 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.066 2.511 . . . . 1.3600000000000001 113.511 -166.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.9 p -75.74 170.42 16.24 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.725 1.61 . . . . 1.9299999999999999 111.926 175.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.11 -42.23 85.26 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.908 -1.12 . . . . 2.23 113.938 -168.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.27 -28.53 64.21 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.222 0.823 . . . . 2.3399999999999999 113.222 176.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.75 -54.03 15.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 124.592 1.157 . . . . 2.5299999999999998 109.93 170.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -51.21 -42.33 60.88 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.716 0.807 . . . . 4.9900000000000002 111.382 175.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.429 ' CG ' ' HE ' ' A' ' 78' ' ' ARG . 20.8 t70 -60.98 -57.19 13.67 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.085 1.354 . . . . 3.1200000000000001 113.262 173.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -66.9 -25.7 66.5 Favored 'General case' 0 N--CA 1.475 0.812 0 O-C-N 120.816 -1.178 . . . . 2.7000000000000002 113.187 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -77.11 -47.78 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 C-N-CA 125.409 1.483 . . . . 1.1399999999999999 110.673 176.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.9 mt -63.16 -34.37 77.49 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.186 -0.946 . . . . 1.03 111.85 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HE ' ' CG ' ' A' ' 74' ' ' ASP . 84.0 mtt-85 -67.49 -36.78 81.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.767 0.827 . . . . 3.79 111.677 171.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.43 -27.59 64.38 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.114 1.153 . . . . 1.1499999999999999 114.114 173.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -70.51 -44.11 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 O-C-N 120.937 -1.102 . . . . 0.94999999999999996 109.492 165.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.01 9.38 87.17 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.985 1.755 . . . . 1.02 113.514 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -157.22 -179.86 8.6 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.005 2.122 . . . . 1.8 110.049 -176.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.1 tpt -75.31 126.07 88.2 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.986 1.714 . . . . 1.3799999999999999 109.823 169.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -75.24 0.6 8.81 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.784 2.322 . . . . 1.4299999999999999 113.104 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 . . . . . 0 C--O 1.256 1.421 0 C-N-CA 125.779 1.632 . . . . 2.5600000000000001 111.901 -176.429 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 N--CA 1.484 1.225 0 CA-C-O 118.019 -0.991 . . . . 3.1099999999999999 109.352 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -57.64 147.57 78.87 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.963 1.776 . . . . 1.97 111.341 161.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.5 m -111.49 77.66 1.06 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.85 1.26 . . . . 1.79 113.863 -165.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.12 -26.26 68.12 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.665 1.186 . . . . 3.2000000000000002 113.443 -176.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 75.2 m -83.12 -43.17 16.53 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.08 0.952 . . . . 2.29 113.19 -175.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -69.32 -25.74 64.36 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.004 -1.06 . . . . 2.8399999999999999 110.388 165.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 51.1 m -63.94 -38.98 93.07 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 121.4 -0.813 . . . . 1.6100000000000001 112.137 167.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -59.93 -43.98 94.62 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.528 1.058 . . . . 3.5699999999999998 111.144 172.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.27 -33.98 76.67 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 119.043 0.838 . . . . 1.6399999999999999 112.918 175.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.6 p -63.58 -38.02 89.53 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.586 -0.696 . . . . 1.6200000000000001 112.202 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.8 m -66.34 -37.95 86.51 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.506 -0.746 . . . . 2.8700000000000001 111.572 173.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 19.8 mmt180 -58.14 -46.16 86.13 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 119.306 0.957 . . . . 4.7300000000000004 110.718 171.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.7 t -56.79 -52.62 64.34 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.833 0.853 . . . . 2.1499999999999999 112.037 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.505 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.0 mp -63.44 -46.93 84.04 Favored 'General case' 0 C--N 1.328 -0.329 0 O-C-N 121.111 -0.993 . . . . 2.6600000000000001 112.13 -175.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -62.64 -29.43 70.62 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.664 1.185 . . . . 4.4400000000000004 112.893 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -64.89 -58.18 6.85 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 120.086 1.312 . . . . 4.3499999999999996 113.717 169.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.06 51.47 0.8 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.726 1.611 . . . . 2.52 111.941 -166.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.5 m120 58.42 36.99 25.76 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 125.706 1.603 . . . . 6.1200000000000001 114.626 164.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.505 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.4 OUTLIER 57.13 85.05 0.09 Allowed 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 128.439 2.696 . . . . 4.4699999999999998 114.091 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -121.66 66.85 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.712 1.605 . . . . 2.04 113.053 -173.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.2 tpt85 -62.92 -15.33 54.92 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.062 1.345 . . . . 6.46 113.063 177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -76.59 -37.13 57.0 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 118.568 -0.73 . . . . 3.8300000000000001 112.769 170.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -76.09 -39.58 54.98 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 119.515 1.052 . . . . 4.0 113.281 172.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.285 18.1 m -96.2 26.24 4.38 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 114.066 1.135 . . . . 1.3100000000000001 114.066 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 90.2 p -62.24 -17.08 57.34 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.73 1.212 . . . . 1.75 113.784 167.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 37.4 p -57.99 -40.39 80.6 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.381 1.873 . . . . 2.6200000000000001 112.466 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -67.98 -39.98 83.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.338 1.055 . . . . 2.4500000000000002 111.635 175.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.464 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 66.2 t80 -63.93 -35.01 79.26 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.737 0.815 . . . . 4.6399999999999997 111.875 172.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 7.0 tp -61.86 -48.74 79.19 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.388 -0.82 . . . . 1.6299999999999999 111.8 168.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -61.51 -29.93 70.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.686 1.13 . . . . 4.9100000000000001 112.735 174.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 39.7 t80 -69.54 -40.93 76.57 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.088 0.555 . . . . 2.7000000000000002 111.358 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 94.5 mttt -62.46 -39.46 93.48 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 118.265 -0.874 . . . . 3.3799999999999999 112.382 168.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 65.2 m-20 -59.07 -36.89 75.84 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.689 1.131 . . . . 1.96 110.709 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 71.0 m -65.87 -20.56 66.28 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 115.102 1.519 . . . . 2.52 115.102 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -89.59 -52.63 4.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.25 1.02 . . . . 5.9699999999999998 111.138 166.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.3 ttp180 -58.27 -37.71 75.51 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 126.6 1.96 . . . . 4.9800000000000004 113.126 -173.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.49 -55.7 25.08 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.751 0.786 . . . . 2.1299999999999999 111.214 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -69.82 -30.46 67.99 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.971 -0.559 . . . . 1.05 112.299 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -61.58 -40.28 94.21 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.421 1.089 . . . . 1.7 112.029 166.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.2 -42.49 99.34 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 121.152 -0.968 . . . . 1.3799999999999999 113.103 170.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.3 mm -59.9 -41.34 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 CA-C-N 119.269 0.941 . . . . 0.57999999999999996 110.772 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -63.4 -42.03 94.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 123.916 0.886 . . . . 1.1399999999999999 111.92 175.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -63.45 -33.68 76.09 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 120.021 1.282 . . . . 2.2999999999999998 112.766 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -76.93 -13.76 59.94 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.958 1.303 . . . . 1.6200000000000001 113.957 172.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -90.67 -26.62 19.49 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.751 -1.218 . . . . 3.6000000000000001 113.753 162.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 45.3 ttt180 -76.21 -29.32 57.54 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.883 1.273 . . . . 3.0800000000000001 112.934 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -55.71 -30.17 60.69 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.569 1.692 . . . . 2.5899999999999999 115.569 178.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -93.92 -14.36 26.09 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 120.056 1.298 . . . . 3.29 114.343 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 68.56 23.38 75.34 Favored Glycine 0 CA--C 1.539 1.561 0 CA-C-N 119.335 0.971 . . . . 3.2200000000000002 115.024 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -113.08 -21.67 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 N-CA-C 116.113 1.894 . . . . 4.6500000000000004 116.113 -148.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -139.88 169.74 11.38 Favored Pre-proline 0 N--CA 1.471 0.597 0 C-N-CA 127.392 2.277 . . . . 2.52 112.383 -170.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -58.49 115.99 2.93 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.537 1.491 . . . . 2.4500000000000002 110.044 155.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.417 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 17.8 m-85 -74.79 -46.24 38.29 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.046 1.128 . . . . 3.3799999999999999 114.046 -169.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 7.4 mmt -57.34 112.92 5.27 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-O 118.815 -0.612 . . . . 1.6899999999999999 109.934 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.52 143.93 59.06 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.263 2.642 . . . . 1.3600000000000001 113.241 -164.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.2 p -76.52 168.24 20.43 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.91 0.884 . . . . 1.9199999999999999 111.045 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.03 -38.94 68.59 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.006 1.113 . . . . 1.6000000000000001 114.006 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.46 -31.02 62.1 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.006 0.821 . . . . 1.4399999999999999 113.199 176.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -66.94 -52.35 44.02 Favored 'General case' 0 C--O 1.227 -0.119 0 O-C-N 121.343 -0.848 . . . . 3.79 108.797 171.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -54.22 -37.81 64.99 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 118.381 -0.818 . . . . 3.5099999999999998 112.448 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -60.9 -56.29 22.92 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.675 0.67 . . . . 2.4199999999999999 110.787 173.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.02 -21.77 65.92 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.484 1.29 . . . . 2.7599999999999998 114.484 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.8 mt -80.15 -44.68 22.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 O-C-N 120.911 -1.118 . . . . 0.96999999999999997 110.206 176.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.36 -33.51 74.87 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 120.947 -1.095 . . . . 1.3100000000000001 111.973 169.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -67.89 -35.9 79.3 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.29 1.036 . . . . 4.1500000000000004 112.136 170.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.03 69.1 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 113.181 0.808 . . . . 1.4399999999999999 113.181 175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.2 t -72.86 -41.64 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 123.376 0.67 . . . . 1.79 109.572 165.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.88 1.79 79.75 Favored Glycine 0 CA--C 1.533 1.174 0 C-N-CA 126.696 2.094 . . . . 2.1800000000000002 113.384 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.91 -176.87 6.14 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 128.778 2.831 . . . . 2.6099999999999999 108.769 -171.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 tpt -76.71 124.12 87.66 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.062 1.345 . . . . 1.8600000000000001 109.559 174.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -72.88 -7.13 20.24 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.238 1.958 . . . . 1.45 113.055 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 C--O 1.25 1.127 0 C-N-CA 124.482 1.113 . . . . 3.0499999999999998 111.718 -173.392 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 118.657 -0.687 . . . . 3.8599999999999999 110.783 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -69.4 173.71 10.25 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.073 3.182 . . . . 1.6499999999999999 112.893 162.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.5 m -122.83 88.52 2.94 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.792 1.237 . . . . 1.1200000000000001 111.001 170.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -64.95 -37.58 88.11 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.142 1.377 . . . . 2.2799999999999998 112.904 -172.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.1 m -75.15 -45.84 38.19 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.976 0.732 . . . . 2.3199999999999998 112.976 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -63.07 -32.11 73.41 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 119.218 0.917 . . . . 2.4700000000000002 110.465 173.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.7 t -63.77 -49.79 71.57 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.058 -0.401 . . . . 1.6799999999999999 111.101 171.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.34 -35.13 79.86 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.271 1.028 . . . . 2.3100000000000001 113.328 177.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.89 -37.37 84.26 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.868 -1.145 . . . . 0.89000000000000001 111.855 174.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 12.5 p -65.57 -40.52 92.88 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.418 0.525 . . . . 1.46 112.418 167.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -58.5 -41.83 86.26 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.962 1.305 . . . . 1.1899999999999999 110.915 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -73.3 -35.49 66.12 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 126.259 1.824 . . . . 4.4800000000000004 113.649 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.5 t -58.42 -53.27 60.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.751 0.786 . . . . 1.0600000000000001 110.269 167.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mp -57.62 -43.15 84.55 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.308 1.043 . . . . 1.3300000000000001 112.367 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.31 -31.42 72.56 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.213 1.805 . . . . 2.75 113.918 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -68.56 -48.01 65.34 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.655 -1.278 . . . . 2.9100000000000001 114.072 171.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.02 55.93 1.62 Allowed 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 114.315 1.228 . . . . 1.6399999999999999 114.315 -159.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 43.1 t30 47.4 47.21 17.15 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.816 1.246 . . . . 3.0899999999999999 114.289 174.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 t80 56.99 61.47 2.58 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.514 1.525 . . . . 3.7200000000000002 114.856 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -84.99 60.28 6.15 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 120.354 -1.466 . . . . 2.7400000000000002 112.769 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 43.2 ttp180 -57.22 -15.55 6.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.026 2.13 . . . . 4.46 114.286 177.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -81.53 -55.71 4.5 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.218 1.407 . . . . 3.7000000000000002 112.392 169.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -63.31 -34.46 77.75 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.538 -1.351 . . . . 3.4500000000000002 112.519 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 98.1 m -96.15 19.06 12.34 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.068 0.947 . . . . 0.90000000000000002 113.318 174.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 2.1 t -64.94 -25.82 68.04 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 121.003 -1.06 . . . . 2.1299999999999999 112.418 171.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.6 p -51.29 -43.53 61.64 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.175 1.39 . . . . 1.95 112.942 170.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -62.64 -45.98 90.33 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.235 1.014 . . . . 2.0699999999999998 110.998 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -68.14 -38.4 82.12 Favored 'General case' 0 CA--C 1.536 0.404 0 O-C-N 121.652 -0.655 . . . . 5.8099999999999996 112.284 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 17.8 tp -60.58 -46.94 88.38 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.729 -0.607 . . . . 1.3799999999999999 111.854 169.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.405 HH21 ' C ' ' A' ' 85' ' ' TYR . 27.1 mtp-105 -69.74 -22.84 63.34 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 120.971 -1.08 . . . . 4.4800000000000004 112.689 178.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -69.46 -43.51 73.11 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.146 0.43 . . . . 2.2599999999999998 110.441 168.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -61.06 -30.83 70.56 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 117.991 -1.004 . . . . 3.0800000000000001 112.415 170.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -71.29 -40.82 70.65 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.153 0.981 . . . . 1.23 111.815 172.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 63.7 m -53.12 -48.61 67.73 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.281 1.4 . . . . 1.48 111.331 170.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -65.15 -51.11 63.13 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.002 0.921 . . . . 3.9300000000000002 110.793 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm180 -59.01 -42.33 89.84 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.979 1.312 . . . . 4.2599999999999998 112.489 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -58.85 -57.24 13.9 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 119.402 1.001 . . . . 1.99 111.221 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -69.51 -31.49 69.77 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.456 0.539 . . . . 0.71999999999999997 112.456 -176.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -64.83 -33.76 76.77 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.404 1.082 . . . . 1.55 112.77 168.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 47.4 t -69.36 -39.58 78.01 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.016 -1.053 . . . . 2.0099999999999998 111.756 172.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.5 mm -60.98 -44.17 97.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 CA-C-N 119.696 1.135 . . . . 0.46999999999999997 110.458 171.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 36.4 t -55.47 -46.09 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 C-N-CA 124.029 0.932 . . . . 0.60999999999999999 111.141 172.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.2 mmt -65.96 -36.02 82.19 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.257 1.389 . . . . 2.2999999999999998 113.702 175.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -74.21 -11.87 60.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.095 1.358 . . . . 1.54 113.382 175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -98.81 -35.12 10.23 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.284 1.033 . . . . 3.7999999999999998 113.217 166.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 50.4 ttt180 -66.8 -27.16 67.35 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.202 1.401 . . . . 2.79 112.982 -178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -51.08 -27.61 8.6 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.198 1.184 . . . . 2.1899999999999999 114.198 169.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -96.83 -14.47 21.85 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.947 1.462 . . . . 2.2999999999999998 114.947 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 62.61 24.13 65.8 Favored Glycine 0 CA--C 1.542 1.742 0 CA-C-N 119.952 1.251 . . . . 1.6499999999999999 116.074 171.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.0 p -132.33 -39.08 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 116.042 1.867 . . . . 2.27 116.042 -158.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -117.04 170.12 6.44 Favored Pre-proline 0 N--CA 1.477 0.905 0 C-N-CA 125.776 1.63 . . . . 2.1499999999999999 111.906 -168.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -56.73 106.77 0.23 Allowed 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 121.642 1.562 . . . . 2.1400000000000001 111.568 164.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 7.8 m-30 -64.86 -45.22 86.96 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 125.284 1.434 . . . . 2.0 111.85 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.1 mmt -68.03 108.55 2.83 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-O 119.007 -0.521 . . . . 1.1499999999999999 110.062 160.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -62.76 149.18 92.1 Favored 'Trans proline' 0 C--N 1.348 0.5 0 C-N-CA 123.219 2.613 . . . . 0.97999999999999998 112.746 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.3 p -83.44 165.03 19.53 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.061 0.944 . . . . 1.1499999999999999 112.135 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.52 -43.94 62.45 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 115.409 1.633 . . . . 1.27 115.409 -166.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.7 64.09 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.391 0.886 . . . . 1.48 113.391 176.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.48 -49.52 63.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.11 0.964 . . . . 2.2599999999999998 108.689 170.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 30.2 mtp-105 -55.76 -38.96 70.54 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 121.516 -0.74 . . . . 3.5800000000000001 112.12 175.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -61.8 -53.17 59.62 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.53 0.732 . . . . 1.9299999999999999 112.738 173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -65.65 -26.88 68.0 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.639 0.978 . . . . 2.0899999999999999 113.639 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.3 mt -75.04 -44.92 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 C-N-CA 125.449 1.5 . . . . 0.75 110.682 176.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.5 mt -61.43 -34.29 75.15 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.813 -1.179 . . . . 0.81999999999999995 111.871 171.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -67.42 -34.93 78.25 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.957 0.903 . . . . 5.4100000000000001 112.224 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.78 -26.75 63.47 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.957 0.903 . . . . 0.92000000000000004 113.393 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.0 t -76.98 -38.63 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 CA-C-N 119.498 1.044 . . . . 0.96999999999999997 110.05 167.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.18 10.04 77.69 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.683 1.135 . . . . 1.1499999999999999 113.592 176.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -157.64 167.89 28.81 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.128 2.571 . . . . 2.73 108.215 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.5 tpt -60.32 125.4 81.65 Favored Pre-proline 0 CA--C 1.541 0.614 0 O-C-N 121.064 -1.022 . . . . 1.1000000000000001 108.816 169.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.35 -4.03 13.6 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.546 2.164 . . . . 1.04 112.409 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.405 ' C ' HH21 ' A' ' 43' ' ' ARG . 6.4 p90 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.352 1.861 . . . . 2.52 112.85 176.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.611 -0.709 . . . . 3.8799999999999999 110.98 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -65.04 151.16 86.7 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.234 2.623 . . . . 1.73 111.005 165.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.32 69.48 2.67 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.348 -0.845 . . . . 1.79 112.891 -169.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.58 -37.68 87.17 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.834 0.854 . . . . 2.6699999999999999 113.131 -173.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -71.25 -43.53 67.08 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 119.634 1.106 . . . . 2.0899999999999999 112.141 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -62.38 -32.06 72.81 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.186 0.594 . . . . 3.4399999999999999 110.106 173.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 m -75.8 -29.52 58.75 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.365 0.876 . . . . 2.2999999999999998 113.365 174.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.45 -32.19 64.22 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.445 -1.41 . . . . 4.29 111.587 171.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.31 -39.81 71.18 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.691 0.796 . . . . 1.8799999999999999 111.184 170.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.8 t -55.86 -46.86 78.12 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.185 0.994 . . . . 1.3 110.905 167.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 m -58.34 -42.03 85.93 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.45 1.1 . . . . 2.2000000000000002 111.901 175.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -66.46 -38.41 87.29 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 118.299 -0.857 . . . . 5.1299999999999999 113.185 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -59.43 -46.2 89.39 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.764 0.711 . . . . 1.74 111.537 168.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.9 OUTLIER -64.83 -40.84 95.84 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.473 1.109 . . . . 2.0899999999999999 112.813 -177.871 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -62.88 -33.39 75.19 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.191 1.397 . . . . 4.1299999999999999 112.942 167.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -66.23 -38.83 88.83 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.879 1.437 . . . . 3.0 114.879 169.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -136.66 77.17 1.63 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.02 1.328 . . . . 1.8400000000000001 113.67 -171.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 50.86 26.67 2.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 116.459 2.022 . . . . 4.1100000000000003 116.459 162.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.599 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.27 0.3 OUTLIER 54.54 39.64 31.28 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.144 1.777 . . . . 5.4000000000000004 113.933 -171.179 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -75.37 69.13 2.14 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 124.992 2.33 . . . . 3.0 111.795 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp85 -54.06 -13.76 0.89 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 112.187 -2.278 . . . . 6.6299999999999999 114.8 174.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -91.88 -33.81 14.77 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.863 1.265 . . . . 4.2999999999999998 112.809 173.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -67.54 -31.4 71.46 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 121.092 -1.005 . . . . 4.8399999999999999 112.832 167.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.257 17.8 m -110.56 23.19 14.54 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.265 1.58 . . . . 1.1699999999999999 115.265 173.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.8 t -58.78 -25.34 62.99 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 120.807 -1.183 . . . . 3.0699999999999998 112.242 169.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.12 -30.4 71.56 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 121.071 -1.018 . . . . 3.6600000000000001 112.986 175.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -68.04 -42.11 81.07 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 121.082 -1.011 . . . . 2.6299999999999999 110.594 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -66.7 -30.71 71.02 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.402 0.681 . . . . 4.5 112.179 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.73 -45.92 84.44 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.992 -1.068 . . . . 2.1899999999999999 111.415 166.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 54.9 mtm-85 -60.68 -30.17 69.75 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.491 1.041 . . . . 4.4400000000000004 112.403 172.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -66.11 -44.04 85.45 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.395 0.678 . . . . 2.8300000000000001 111.833 171.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -65.85 -27.8 68.51 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.233 -0.917 . . . . 3.71 112.722 170.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -70.96 -39.85 72.32 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 119.269 0.941 . . . . 1.8200000000000001 111.768 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.7 m -55.43 -46.26 76.73 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 119.751 1.159 . . . . 2.1499999999999999 110.587 169.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -62.99 -42.07 99.74 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.871 0.868 . . . . 3.6400000000000001 111.482 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 54.4 ttm-85 -62.15 -43.61 98.46 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.128 0.971 . . . . 4.71 112.94 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -58.72 -55.92 28.93 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.907 0.86 . . . . 1.99 111.187 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -66.35 -30.81 71.29 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 118.359 -0.829 . . . . 1.1599999999999999 112.65 -178.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -64.53 -34.0 77.21 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 120.425 1.466 . . . . 2.9700000000000002 112.984 167.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -66.11 -42.51 89.12 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.679 -0.638 . . . . 1.28 110.584 173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.9 mm -61.47 -42.33 93.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 O-C-N 121.496 -0.753 . . . . 0.57999999999999996 111.154 173.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.5 t -56.46 -48.1 80.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 123.982 0.913 . . . . 0.88 111.15 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.4 mmt -66.93 -35.13 79.29 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.89 1.223 . . . . 2.1200000000000001 113.38 177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.431 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 77.6 mm-40 -74.28 -12.63 60.6 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.842 0.857 . . . . 2.0299999999999998 112.896 174.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 mtt85 -94.72 -31.8 13.63 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 120.424 -1.423 . . . . 2.3500000000000001 113.594 163.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -66.94 -20.94 65.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.132 1.373 . . . . 2.9199999999999999 112.838 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 57' ' ' GLN . 15.1 ptpt -52.0 -27.73 14.48 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.499 1.12 . . . . 1.98 113.856 169.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -106.43 -10.08 16.45 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.55 1.315 . . . . 2.1200000000000001 114.55 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.04 15.19 60.17 Favored Glycine 0 CA--C 1.543 1.815 0 N-CA-C 116.77 1.468 . . . . 1.3400000000000001 116.77 168.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -111.48 -24.22 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 115.766 1.765 . . . . 2.2000000000000002 115.766 -154.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -132.54 169.34 14.18 Favored Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 126.363 1.865 . . . . 3.0899999999999999 113.243 -171.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -57.27 115.48 2.53 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 121.699 1.599 . . . . 2.1899999999999999 110.107 155.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -78.37 -43.03 28.7 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.811 1.244 . . . . 2.1699999999999999 112.999 -170.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.7 mmt -56.47 112.56 4.59 Favored Pre-proline 0 CA--C 1.541 0.614 0 C-N-CA 124.594 1.158 . . . . 1.76 109.197 168.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -67.71 141.42 54.57 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.862 2.375 . . . . 1.6799999999999999 113.564 -162.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.1 p -72.38 165.89 23.63 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.111 1.764 . . . . 1.96 111.568 170.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.58 -39.04 72.83 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.879 1.066 . . . . 2.2000000000000002 113.879 -170.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.49 -36.68 76.73 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 112.982 0.734 . . . . 2.1600000000000001 112.982 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -66.99 -53.65 29.4 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 124.386 1.074 . . . . 3.0099999999999998 109.266 174.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -47.81 -46.03 30.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.176 1.39 . . . . 4.8300000000000001 111.589 174.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -62.26 -55.45 28.25 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.082 0.953 . . . . 3.3500000000000001 112.799 177.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -68.41 -27.6 66.35 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.959 0.725 . . . . 3.0099999999999998 112.959 -177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 51.2 mt -74.15 -44.28 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 C-N-CA 125.116 1.366 . . . . 1.3200000000000001 110.309 177.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.1 mt -60.77 -37.61 82.46 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.018 0.826 . . . . 1.3100000000000001 112.227 171.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -66.03 -36.93 84.59 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.032 0.533 . . . . 5.4199999999999999 111.817 173.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.83 -34.2 73.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.765 0.654 . . . . 1.6100000000000001 112.765 176.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.7 t -66.57 -40.08 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 O-C-N 121.261 -0.899 . . . . 1.1100000000000001 109.729 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.03 13.12 84.01 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.831 1.205 . . . . 1.2 113.079 178.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -162.05 173.47 14.34 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 127.475 2.31 . . . . 1.6599999999999999 108.557 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -59.82 130.83 88.7 Favored Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.261 1.025 . . . . 1.6100000000000001 108.465 160.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -70.05 -15.41 36.01 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.622 1.548 . . . . 1.5700000000000001 111.863 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 33.4 p90 . . . . . 0 C--O 1.254 1.301 0 C-N-CA 126.86 2.064 . . . . 3.1200000000000001 113.717 -176.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 118.214 -0.898 . . . . 3.75 110.385 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -69.67 170.37 16.63 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 123.574 2.849 . . . . 1.76 113.468 167.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -110.24 77.93 1.09 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.815 1.293 . . . . 1.3600000000000001 112.695 -173.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.8 mp -59.67 -32.79 70.8 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.129 1.372 . . . . 3.1200000000000001 111.984 -176.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.35 -57.19 10.05 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.721 2.009 . . . . 1.8799999999999999 111.376 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.3 mp0 -64.09 -34.12 77.32 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.641 1.176 . . . . 3.2599999999999998 110.309 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.3 t -64.52 -42.01 96.03 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.684 -0.635 . . . . 1.79 112.237 175.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -72.53 -35.36 68.06 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 121.044 -1.035 . . . . 2.8199999999999998 112.876 176.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.34 -35.26 80.3 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 118.828 0.74 . . . . 1.0700000000000001 111.387 172.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -58.61 -46.43 87.05 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.582 -0.699 . . . . 2.1699999999999999 110.98 164.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.1 m -55.53 -34.26 64.53 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 120.794 -1.191 . . . . 1.51 113.048 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.34 -38.47 78.16 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 119.762 1.164 . . . . 5.5999999999999996 113.604 172.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 4.4 t -59.99 -44.25 94.63 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.232 1.015 . . . . 1.3200000000000001 111.034 168.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.648 HD23 ' CE1' ' A' ' 32' ' ' TYR . 0.8 OUTLIER -68.18 -38.51 82.11 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.016 1.326 . . . . 1.3799999999999999 112.533 -176.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.33 -44.46 92.62 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.52 1.128 . . . . 3.1299999999999999 112.092 165.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -53.2 -51.35 62.41 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.488 1.292 . . . . 3.54 114.488 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -129.39 80.16 1.95 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.723 1.609 . . . . 1.6399999999999999 113.758 -168.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 43.2 36.59 1.04 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 116.714 2.116 . . . . 3.0099999999999998 116.714 164.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.648 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.267 0.3 OUTLIER 52.22 41.32 30.21 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.198 1.799 . . . . 4.0099999999999998 114.678 -173.513 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -80.23 67.75 6.16 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 124.059 1.885 . . . . 2.7999999999999998 112.306 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.5 ptt180 -59.94 -12.74 8.5 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 113.775 -1.557 . . . . 4.7000000000000002 114.434 171.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -77.38 -44.44 29.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 119.155 0.889 . . . . 3.7200000000000002 111.419 168.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -60.6 -42.96 97.82 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.062 0.846 . . . . 4.6299999999999999 111.703 170.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.2 m -100.09 35.27 2.1 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.295 1.22 . . . . 1.1100000000000001 114.295 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.9 m -67.52 -19.35 65.29 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.464 1.106 . . . . 2.2999999999999998 113.646 171.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.7 p -46.97 -50.65 18.71 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 126.245 1.818 . . . . 2.2400000000000002 113.339 170.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -64.27 -43.38 94.98 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.095 0.958 . . . . 2.1600000000000001 111.506 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -70.77 -26.31 63.29 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.314 -0.866 . . . . 6.1299999999999999 112.595 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tp -66.46 -48.69 69.13 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.06 0.944 . . . . 1.0 111.431 166.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -61.42 -30.2 70.42 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 121.096 -1.002 . . . . 4.3700000000000001 112.03 174.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 34.6 t80 -68.04 -43.41 78.77 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.565 -0.71 . . . . 2.3999999999999999 111.534 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -64.38 -29.63 70.69 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.336 1.455 . . . . 2.9199999999999999 112.6 174.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -67.44 -46.07 74.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.474 1.11 . . . . 1.04 111.421 170.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.3 m -58.23 -43.13 87.58 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.875 0.761 . . . . 1.6299999999999999 110.9 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -61.98 -53.3 57.53 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.333 1.053 . . . . 4.5599999999999996 112.169 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -58.44 -42.58 87.66 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 119.535 1.062 . . . . 4.9800000000000004 112.243 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -57.1 -60.26 3.86 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 123.799 0.839 . . . . 1.8600000000000001 110.966 176.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -71.23 -31.19 67.27 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-O 118.491 -0.766 . . . . 0.68999999999999995 113.035 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -56.96 -40.68 76.92 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 120.303 1.411 . . . . 1.6200000000000001 111.833 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.9 m -68.14 -42.09 80.65 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.452 0.701 . . . . 1.3300000000000001 112.093 175.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.0 mm -58.71 -41.36 82.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 119.697 1.135 . . . . 0.53000000000000003 110.678 174.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.09 -50.3 80.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 117.929 -1.034 . . . . 0.64000000000000001 111.348 173.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.7 mmt -54.69 -43.71 72.74 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-N 120.671 1.578 . . . . 2.1200000000000001 112.832 173.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -76.37 -16.03 59.82 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.137 0.975 . . . . 1.48 113.274 -176.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -96.24 -20.44 18.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.576 1.55 . . . . 2.5299999999999998 113.556 170.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -75.54 -18.21 59.85 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.182 0.993 . . . . 4.7599999999999998 113.049 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -52.05 -34.44 43.48 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.549 1.14 . . . . 1.9199999999999999 113.86 177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -93.88 -11.63 30.67 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.842 1.423 . . . . 2.1099999999999999 114.842 175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 64.18 25.99 70.09 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 115.917 1.127 . . . . 1.3899999999999999 115.917 167.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 8.7 p -138.02 -48.62 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.484 1.113 . . . . 1.8700000000000001 113.952 -163.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.3 ptpp? -74.35 166.31 45.97 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 125.12 1.368 . . . . 2.52 112.763 177.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -58.7 121.0 9.22 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.718 1.612 . . . . 1.72 110.876 158.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -75.77 -45.77 34.43 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.658 1.183 . . . . 1.95 112.355 -177.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 16.1 mmt -68.19 114.54 21.78 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 123.597 0.759 . . . . 0.97999999999999998 109.419 159.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.67 152.53 74.36 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.165 2.577 . . . . 1.1699999999999999 113.338 -170.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.8 p -75.7 167.7 21.4 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.016 0.926 . . . . 1.3600000000000001 110.77 166.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.01 -34.16 72.98 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.226 1.195 . . . . 1.3 114.226 -173.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.73 78.19 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.48 1.112 . . . . 1.5900000000000001 112.572 174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -69.24 -51.43 37.76 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.852 1.261 . . . . 3.3399999999999999 108.992 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.2 ttp180 -49.82 -44.25 49.23 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.214 1.406 . . . . 5.7699999999999996 111.739 172.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -62.41 -52.79 62.19 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.934 0.893 . . . . 2.5800000000000001 111.919 177.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -65.63 -27.65 68.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.464 1.029 . . . . 2.3199999999999998 113.615 177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 29.5 mt -72.35 -47.68 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.122 1.369 . . . . 1.02 111.233 177.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.56 -36.85 85.14 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.482 -0.761 . . . . 1.0900000000000001 111.593 173.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 65.9 mtp180 -66.3 -32.23 73.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.625 0.77 . . . . 4.9000000000000004 111.434 172.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.27 -26.22 60.08 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.377 1.071 . . . . 1.0900000000000001 113.831 172.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.7 -42.5 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 119.533 1.06 . . . . 1.05 110.522 163.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.75 6.76 87.22 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.967 1.27 . . . . 1.1799999999999999 113.668 -176.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 59.6 t30 -155.08 162.78 40.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.653 1.981 . . . . 1.8400000000000001 110.153 179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -74.39 124.23 89.71 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 124.293 1.037 . . . . 2.1699999999999999 109.693 170.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -75.3 0.14 9.38 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.62 2.214 . . . . 1.9199999999999999 113.165 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 . . . . . 0 C--O 1.254 1.337 0 C-N-CA 127.409 2.284 . . . . 3.3300000000000001 111.248 -176.684 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.323 -0.846 . . . . 4.0199999999999996 109.533 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -81.57 147.92 15.86 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.756 2.971 . . . . 2.4399999999999999 111.732 170.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 19.3 m -87.27 72.57 9.84 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.515 0.932 . . . . 1.53 113.515 -170.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.84 -28.39 35.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.647 1.579 . . . . 3.21 113.219 174.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.8 m -66.35 -48.76 69.19 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.734 1.614 . . . . 1.9099999999999999 112.805 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -66.76 -33.91 76.67 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 119.165 -0.445 . . . . 2.1899999999999999 109.989 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.2 t -65.37 -37.46 87.09 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 121.461 0.648 . . . . 1.78 112.126 175.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -70.76 -44.93 65.71 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.807 1.243 . . . . 2.9300000000000002 111.654 174.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.7 -38.4 86.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.229 1.012 . . . . 1.3 112.876 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.1 t -54.96 -52.9 61.59 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.516 1.927 . . . . 1.3600000000000001 112.056 163.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.6 m -61.08 -35.73 77.75 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 120.582 -1.324 . . . . 1.8899999999999999 112.377 179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -66.65 -41.9 87.5 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.57 1.548 . . . . 4.9199999999999999 112.77 171.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.4 t -57.02 -47.24 81.38 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.614 0.766 . . . . 1.3600000000000001 110.665 170.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD23 ' CE1' ' A' ' 32' ' ' TYR . 1.6 mp -64.61 -36.48 84.37 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 125.155 1.382 . . . . 1.3600000000000001 113.699 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.33 -37.17 86.2 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 113.407 0.892 . . . . 2.9399999999999999 113.407 164.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -70.94 -29.41 65.42 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 116.608 2.077 . . . . 3.5099999999999998 116.608 176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -142.25 71.04 1.34 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.824 1.249 . . . . 1.51 112.44 -174.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 53.79 30.05 10.67 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 116.031 1.863 . . . . 3.8700000000000001 116.031 158.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.52 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.285 0.2 OUTLIER 57.01 37.98 29.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.9 2.08 . . . . 2.6800000000000002 115.264 -172.268 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -77.56 66.44 3.28 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 124.214 1.959 . . . . 2.2999999999999998 113.42 -179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -70.46 9.18 0.66 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.578 -1.646 . . . . 4.2800000000000002 115.36 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -90.09 -40.27 12.37 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 119.375 0.989 . . . . 3.2599999999999998 111.408 165.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -79.85 -37.22 35.4 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 121.495 -0.753 . . . . 4.9400000000000004 112.251 171.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.253 12.7 m -90.04 23.78 2.69 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.435 0.902 . . . . 1.0600000000000001 113.435 168.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.9 p -62.63 -27.14 69.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.026 0.93 . . . . 2.5699999999999998 112.489 165.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 47.3 p -53.22 -42.86 66.76 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.333 1.453 . . . . 2.3599999999999999 112.65 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -62.6 -46.56 87.74 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 124.595 1.158 . . . . 2.3700000000000001 112.531 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.8 t80 -65.39 -36.8 85.08 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.505 0.722 . . . . 4.3399999999999999 111.409 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 19.8 tp -62.69 -51.17 68.27 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.363 1.065 . . . . 1.3 112.519 170.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -66.66 -24.03 66.23 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.298 -0.876 . . . . 5.75 111.74 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -70.82 -45.91 63.74 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.26 1.024 . . . . 2.9399999999999999 110.801 171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -58.75 -43.32 90.24 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 118.4 -0.81 . . . . 3.0699999999999998 111.123 172.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 51.9 m-20 -62.37 -45.55 92.64 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.381 1.073 . . . . 1.3899999999999999 112.288 175.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 t -56.28 -54.3 46.99 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.99 1.716 . . . . 1.78 111.949 176.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.35 -34.98 77.07 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.864 0.69 . . . . 7.9000000000000004 112.864 178.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -62.08 -37.93 86.9 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.348 1.059 . . . . 4.4299999999999997 112.206 179.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -61.89 -58.42 8.0 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.953 0.882 . . . . 2.2799999999999998 110.491 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.6 m95 -62.22 -37.38 85.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.431 -0.804 . . . . 0.84999999999999998 112.525 -178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -60.76 -37.88 83.36 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.933 1.293 . . . . 1.8200000000000001 112.501 170.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.1 t -62.98 -47.32 83.66 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.465 -0.772 . . . . 2.2200000000000002 111.369 172.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.7 mm -61.26 -45.51 98.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 123.842 0.857 . . . . 0.83999999999999997 111.481 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -51.96 -51.18 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 125.46 1.504 . . . . 0.95999999999999996 110.43 172.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 57.7 mtt -65.13 -35.19 80.35 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.254 0.934 . . . . 2.6899999999999999 113.264 177.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -67.89 -33.08 74.03 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.169 -0.957 . . . . 1.5600000000000001 112.486 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -88.73 -29.94 19.45 Favored 'General case' 0 N--CA 1.479 0.98 0 N-CA-C 113.727 1.01 . . . . 4.3899999999999997 113.727 174.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -67.67 -18.85 65.08 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.863 1.265 . . . . 3.8300000000000001 113.689 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -52.99 -25.21 11.34 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.017 1.488 . . . . 2.71 115.017 171.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -84.39 -24.77 29.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.846 0.858 . . . . 2.29 113.035 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 74.67 15.64 80.57 Favored Glycine 0 CA--C 1.537 1.445 0 N-CA-C 116.918 1.527 . . . . 1.8999999999999999 116.918 169.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.5 p -133.82 -1.37 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 116.021 1.86 . . . . 2.5600000000000001 116.021 -156.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -136.24 169.47 13.42 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 126.053 1.741 . . . . 2.4100000000000001 112.856 -168.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -59.81 119.32 6.47 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.01 1.807 . . . . 1.53 111.36 168.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -77.99 -47.98 17.25 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 123.632 0.773 . . . . 3.1000000000000001 112.543 -169.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.9 mmt -65.46 122.43 80.19 Favored Pre-proline 0 CA--C 1.542 0.657 0 N-CA-C 109.546 -0.538 . . . . 1.3300000000000001 109.546 164.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -65.02 137.46 52.72 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 123.0 2.466 . . . . 1.1000000000000001 111.594 -175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.4 p -71.64 161.5 30.9 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.773 1.229 . . . . 1.1499999999999999 111.231 178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.35 -40.64 59.56 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 114.639 1.348 . . . . 1.3100000000000001 114.639 -169.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.25 -39.82 89.76 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.145 0.978 . . . . 1.3200000000000001 113.515 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.76 -52.27 32.26 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 125.39 1.476 . . . . 2.1899999999999999 109.019 176.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -49.52 -43.07 45.38 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.762 1.625 . . . . 3.7400000000000002 111.772 174.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -64.01 -56.33 15.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.742 0.817 . . . . 2.3999999999999999 112.228 175.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.92 -19.42 64.2 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.698 0.999 . . . . 2.6000000000000001 113.698 -176.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.0 mt -83.48 -41.32 16.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.973 1.709 . . . . 1.04 111.172 176.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 20.2 mt -57.28 -37.78 72.94 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.581 1.082 . . . . 0.93999999999999995 111.081 166.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.0 mtt-85 -69.1 -35.39 76.4 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.607 0.763 . . . . 4.7000000000000002 111.846 174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.5 72.47 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.653 0.983 . . . . 1.05 113.653 172.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 67.0 t -72.17 -43.47 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 119.571 1.078 . . . . 1.1399999999999999 109.361 169.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 79.37 2.1 87.08 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.821 1.2 . . . . 1.24 113.429 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -148.92 169.56 20.29 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.371 1.868 . . . . 2.6200000000000001 109.06 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.15 132.18 95.0 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.642 -0.873 . . . . 1.5700000000000001 108.642 164.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -72.74 -11.49 25.97 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 121.749 1.633 . . . . 1.5700000000000001 112.561 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.2 p90 . . . . . 0 C--O 1.254 1.306 0 C-N-CA 127.074 2.149 . . . . 3.0099999999999998 113.17 -179.765 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.3 m120 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 118.771 -0.633 . . . . 4.5499999999999998 110.078 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.51 157.94 59.44 Favored 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 123.122 2.548 . . . . 3.3300000000000001 111.646 168.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -95.86 85.14 4.01 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 122.325 1.059 . . . . 2.6000000000000001 111.687 -173.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.95 -28.98 70.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.914 1.286 . . . . 4.5700000000000003 112.863 -177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.7 m -63.97 -55.22 24.03 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.464 1.105 . . . . 3.7200000000000002 111.537 178.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.5 mp0 -63.63 -33.66 76.1 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.983 1.313 . . . . 2.3900000000000001 111.58 172.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.5 t -67.65 -40.64 84.51 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 121.531 -0.731 . . . . 1.8300000000000001 112.195 176.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.49 -47.79 66.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.58 1.152 . . . . 3.29 111.093 174.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.87 -34.13 77.42 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.503 0.721 . . . . 1.7 112.669 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.5 p -72.94 -39.19 66.43 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.121 0.786 . . . . 1.6200000000000001 113.121 170.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.5 m -58.52 -43.46 89.17 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 119.798 1.181 . . . . 1.5700000000000001 110.704 171.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 49.7 mtp180 -63.52 -39.52 94.64 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.097 1.759 . . . . 5.8700000000000001 112.477 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -60.28 -49.12 78.85 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.566 1.146 . . . . 2.04 111.54 172.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.405 HD23 ' CE1' ' A' ' 32' ' ' TYR . 2.6 mp -66.43 -34.58 78.26 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 120.849 -1.157 . . . . 2.25 112.379 -176.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.2 -35.65 74.06 Favored 'General case' 0 CA--C 1.556 1.182 0 N-CA-C 114.317 1.228 . . . . 3.8399999999999999 114.317 165.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -59.37 -52.83 63.93 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.651 1.581 . . . . 3.46 113.397 172.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -124.35 55.42 1.31 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.206 1.802 . . . . 2.4300000000000002 112.261 -166.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 42.06 56.41 3.55 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 125.824 1.65 . . . . 5.0300000000000002 115.002 169.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.405 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.29 0.2 OUTLIER 50.82 39.17 21.65 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 127.976 2.511 . . . . 3.1400000000000001 116.239 178.84 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -76.99 65.56 2.66 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 123.701 1.715 . . . . 3.1800000000000002 112.114 175.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 0.26 1.2 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.454 1.502 . . . . 5.9299999999999997 114.377 168.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.76 -40.56 13.12 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.353 1.061 . . . . 3.3599999999999999 111.143 169.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 -68.3 -48.54 64.67 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.579 1.152 . . . . 4.9400000000000004 112.562 168.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 28.8 m -84.27 20.94 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.81 1.041 . . . . 1.55 113.81 178.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 88.0 p -53.38 -38.5 63.43 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.815 1.246 . . . . 2.2200000000000002 112.965 174.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -51.2 -36.25 40.47 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.216 1.806 . . . . 2.79 113.642 177.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -69.94 -40.6 75.39 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.322 -0.861 . . . . 2.8599999999999999 110.791 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -70.74 -33.5 70.9 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.793 0.837 . . . . 5.8899999999999997 111.851 177.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.9 tp -59.09 -51.6 69.33 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.12 0.968 . . . . 1.5 112.041 165.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.91 -26.52 68.64 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 121.025 -1.047 . . . . 6.0800000000000001 113.041 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -77.5 -41.5 39.14 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.408 0.683 . . . . 2.9100000000000001 111.133 174.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.5 mtmt -62.4 -26.65 68.6 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.331 1.052 . . . . 4.0300000000000002 112.868 170.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -68.48 -36.96 79.7 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.22 1.373 . . . . 1.8799999999999999 112.069 173.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.2 m -64.27 -48.62 75.03 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.847 0.859 . . . . 2.4500000000000002 110.402 171.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -58.46 -51.16 71.03 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.177 0.991 . . . . 6.8600000000000003 112.815 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 59.0 ttm-85 -58.25 -40.72 82.51 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.659 1.184 . . . . 3.5299999999999998 112.523 -176.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -59.76 -60.2 4.22 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.491 0.587 . . . . 2.1099999999999999 110.248 175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -66.87 -30.25 70.37 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.078 0.769 . . . . 1.1000000000000001 113.078 -174.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 -67.54 -33.66 75.5 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.814 1.645 . . . . 2.4700000000000002 112.613 169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.4 m -69.37 -40.44 77.44 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 120.841 -1.162 . . . . 1.4199999999999999 111.774 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.438 HG21 HD13 ' A' ' 76' ' ' ILE . 45.8 mm -61.96 -40.44 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.775 0.83 . . . . 0.66000000000000003 110.693 173.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -57.25 -52.01 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 124.71 1.204 . . . . 1.1899999999999999 110.765 171.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 94.6 mmm -59.96 -36.77 77.82 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 119.423 1.011 . . . . 2.1299999999999999 113.148 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -75.95 -25.58 56.06 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.54 0.941 . . . . 1.6599999999999999 113.54 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -80.21 -32.51 38.52 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 119.956 1.253 . . . . 3.54 112.236 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -62.94 -15.88 57.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.023 1.729 . . . . 3.7400000000000002 113.776 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 13.6 pttp -53.0 -32.22 45.23 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.003 1.112 . . . . 3.5 114.003 171.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -79.41 -24.26 42.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.991 0.916 . . . . 3.3999999999999999 112.451 179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.36 14.65 71.95 Favored Glycine 0 CA--C 1.537 1.426 0 C-N-CA 125.038 1.304 . . . . 2.0299999999999998 116.134 175.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.0 p -150.18 -16.55 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 N-CA-C 115.709 1.744 . . . . 3.4399999999999999 115.709 -157.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -104.46 168.84 7.94 Favored Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 126.793 2.037 . . . . 2.02 112.118 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -59.94 122.21 11.06 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 121.27 1.313 . . . . 1.5900000000000001 110.381 156.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.5 m-30 -81.28 -45.13 16.69 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.696 1.598 . . . . 2.96 111.401 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.6 mmt -59.41 109.81 2.23 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 123.598 0.759 . . . . 1.3100000000000001 109.13 161.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.53 145.84 59.77 Favored 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 123.393 2.729 . . . . 0.90000000000000002 114.098 -161.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.8 p -76.37 172.6 12.65 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.426 1.891 . . . . 1.74 111.926 173.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -51.0 59.74 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 113.495 0.924 . . . . 2.4700000000000002 113.495 -175.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.91 -34.45 78.44 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.461 0.912 . . . . 2.8700000000000001 113.461 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -69.01 -54.52 14.73 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.979 1.312 . . . . 3.5099999999999998 109.769 175.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.6 mtp-105 -50.38 -42.88 54.04 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.694 0.798 . . . . 4.6600000000000001 111.749 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -65.26 -52.91 51.37 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.911 0.885 . . . . 4.0899999999999999 112.557 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -64.69 -27.54 68.99 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.645 1.111 . . . . 3.5 112.767 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.438 HD13 HG21 ' A' ' 54' ' ' ILE . 20.3 mt -70.76 -51.25 37.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.357 1.463 . . . . 1.5600000000000001 111.14 175.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.31 -34.29 77.99 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.179 -0.951 . . . . 1.8 112.482 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -64.03 -38.85 92.58 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.96 1.304 . . . . 7.6200000000000001 111.428 169.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.48 -29.89 67.65 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.014 -0.994 . . . . 1.73 113.621 174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.91 -48.47 70.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 CA-C-N 119.637 1.108 . . . . 1.8500000000000001 110.156 167.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 73.85 10.3 80.28 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 123.954 0.788 . . . . 2.0499999999999998 113.379 -172.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.24 171.73 18.07 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.814 2.046 . . . . 2.4399999999999999 109.918 178.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.3 tpt -62.37 126.59 88.31 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.804 -0.813 . . . . 2.02 108.804 160.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -76.3 2.25 7.45 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.903 2.402 . . . . 1.8899999999999999 112.988 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 18.5 p90 . . . . . 0 C--O 1.252 1.232 0 C-N-CA 125.539 1.536 . . . . 3.8100000000000001 113.511 177.068 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 118.732 -0.651 . . . . 3.0899999999999999 110.184 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -53.14 121.47 9.45 Favored 'Trans proline' 0 C--N 1.349 0.586 0 N-CA-C 108.334 -1.449 . . . . 2.3100000000000001 108.334 153.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.79 62.79 2.32 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 112.204 0.446 . . . . 1.8300000000000001 112.204 -156.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -48.85 -30.31 5.65 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 125.686 1.595 . . . . 2.6499999999999999 113.094 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.4 m -65.42 -36.89 85.29 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.963 2.105 . . . . 2.0600000000000001 114.151 177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -86.92 -32.14 20.31 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.6 1.16 . . . . 2.27 110.139 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.8 m -67.28 -30.46 70.33 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 118.545 0.611 . . . . 1.3600000000000001 112.325 178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -67.49 -47.52 69.79 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.557 0.743 . . . . 2.5600000000000001 111.216 169.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.31 75.59 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 121.438 -0.789 . . . . 1.05 112.663 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -58.28 -50.31 74.06 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.212 1.805 . . . . 1.3500000000000001 112.096 164.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -59.5 -43.47 93.36 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.233 -0.917 . . . . 1.5600000000000001 111.39 176.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -34.73 78.56 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.747 1.619 . . . . 5.5099999999999998 112.644 173.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.9 t -65.73 -46.31 79.39 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.428 1.013 . . . . 1.52 111.498 172.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.5 mp -69.52 -32.58 71.52 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.154 0.982 . . . . 1.8200000000000001 112.917 -176.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -65.73 -39.2 90.91 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.379 1.471 . . . . 3.9500000000000002 112.855 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.78 -55.88 25.4 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.389 1.075 . . . . 3.5600000000000001 113.124 173.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -122.41 69.54 0.97 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.968 1.307 . . . . 2.1099999999999999 113.225 -166.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 44.79 39.73 3.73 Favored 'General case' 0 CA--C 1.551 1.001 0 N-CA-C 115.594 1.701 . . . . 4.9900000000000002 115.594 165.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.512 ' CE1' HD23 ' A' ' 27' ' ' LEU 0.263 0.3 OUTLIER 56.62 43.77 24.97 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.438 1.895 . . . . 3.23 115.549 -179.244 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.08 63.05 3.64 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 123.511 1.624 . . . . 2.21 113.023 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -49.31 -21.06 0.75 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 127.365 2.266 . . . . 5.0099999999999998 115.205 172.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -84.64 -40.41 17.48 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.936 0.894 . . . . 4.2199999999999998 111.865 178.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 44.4 mmm-85 -67.97 -43.26 79.41 Favored 'General case' 0 N--CA 1.475 0.823 0 O-C-N 121.516 -0.74 . . . . 5.1200000000000001 111.173 171.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . 0.25 9.4 m -87.83 26.33 1.35 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.366 1.247 . . . . 0.97999999999999998 114.366 175.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.3 p -64.42 -12.69 45.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.737 1.215 . . . . 1.8700000000000001 113.324 165.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 20.9 p -53.83 -45.83 70.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.329 1.852 . . . . 2.21 112.297 169.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -68.51 -39.09 81.38 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.706 0.803 . . . . 2.2200000000000002 112.382 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -61.85 -37.81 85.87 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.737 -0.602 . . . . 5.0899999999999999 111.621 172.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.3 tp -64.82 -49.42 70.69 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.152 -0.967 . . . . 1.3200000000000001 112.449 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 93.7 mtt-85 -67.83 -22.9 65.12 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 118.66 0.664 . . . . 5.3300000000000001 112.678 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -72.79 -46.4 53.48 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.574 0.75 . . . . 2.3500000000000001 110.152 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -59.6 -40.59 87.97 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 118.367 -0.825 . . . . 2.6000000000000001 111.603 172.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -59.86 -44.67 94.03 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.957 1.253 . . . . 1.5 111.76 173.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.9 t -63.76 -21.11 66.25 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.645 1.578 . . . . 2.1899999999999999 114.735 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 6.5 mmm180 -87.04 -54.0 4.56 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.144 1.378 . . . . 4.25 111.531 166.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.3 ttp180 -59.46 -35.44 74.06 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.748 2.019 . . . . 4.5099999999999998 113.413 -175.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -60.87 -55.08 37.25 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 119.613 1.097 . . . . 2.1699999999999999 110.891 174.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -72.08 -33.58 68.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 118.705 -0.664 . . . . 0.93000000000000005 112.624 -176.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -62.28 -35.59 79.47 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 119.501 1.046 . . . . 1.79 112.423 166.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 m -63.9 -42.94 97.32 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 120.968 -1.082 . . . . 1.45 111.255 172.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.6 mm -62.29 -41.14 90.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 118.724 0.693 . . . . 0.58999999999999997 111.427 174.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.72 -49.13 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.066 0.947 . . . . 0.83999999999999997 111.246 174.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 23.1 mmt -65.02 -38.78 92.03 Favored 'General case' 0 N--CA 1.472 0.625 0 O-C-N 121.201 -0.937 . . . . 2.6899999999999999 112.687 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -70.03 -23.85 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.971 0.908 . . . . 1.3999999999999999 113.022 176.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 19.4 mtt85 -85.68 -23.02 27.61 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.448 1.099 . . . . 2.75 113.662 168.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -78.83 -22.54 46.03 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.939 1.088 . . . . 3.75 113.939 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 50.1 pttt -57.5 -29.11 64.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.112 1.153 . . . . 2.6600000000000001 114.112 177.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -92.62 -9.24 41.7 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.845 1.795 . . . . 2.5800000000000001 115.845 171.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 65.53 22.49 69.69 Favored Glycine 0 CA--C 1.536 1.39 0 N-CA-C 116.492 1.357 . . . . 2.0699999999999998 116.492 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.514 HG13 ' H ' ' A' ' 64' ' ' LYS . 4.1 p -121.72 -73.69 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.924 1.362 . . . . 2.4300000000000002 113.771 -164.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.514 ' H ' HG13 ' A' ' 63' ' ' VAL . 0.6 OUTLIER -62.7 166.86 6.62 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 127.325 2.25 . . . . 2.6400000000000001 113.563 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -61.83 126.92 20.04 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 121.082 1.188 . . . . 2.1000000000000001 110.181 160.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -77.22 -42.82 35.88 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.801 0.841 . . . . 2.3900000000000001 112.264 -173.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.8 mmt -61.55 117.34 26.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 123.725 0.81 . . . . 1.51 111.401 162.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.42 151.89 43.19 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 124.114 3.209 . . . . 1.22 113.786 -173.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 43.2 p -73.79 169.32 17.62 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.115 1.366 . . . . 2.0800000000000001 112.315 175.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.34 78.07 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.045 -1.035 . . . . 1.25 112.994 -178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.78 -35.32 74.79 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.049 1.34 . . . . 1.3200000000000001 113.634 174.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -69.99 -53.26 18.47 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.281 1.432 . . . . 4.0 108.34 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt-85 -49.44 -43.6 44.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.846 0.858 . . . . 4.0499999999999998 112.164 173.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -62.53 -54.49 39.04 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.104 0.779 . . . . 2.0099999999999998 113.104 176.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -64.77 -31.39 72.6 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.264 0.938 . . . . 2.3900000000000001 113.019 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -70.41 -48.84 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 125.757 1.623 . . . . 0.88 111.114 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -62.47 -36.73 83.38 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.056 -1.028 . . . . 1.1499999999999999 111.781 174.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.5 mtt-85 -65.16 -35.9 82.54 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.545 0.738 . . . . 4.6799999999999997 111.666 172.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.93 -25.44 61.04 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.792 1.034 . . . . 1.5900000000000001 113.792 174.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.5 t -69.1 -47.56 74.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 CA-C-N 119.529 1.058 . . . . 1.53 109.254 162.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 80.36 6.56 89.19 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 125.468 1.508 . . . . 1.99 113.561 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -156.95 179.24 9.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.888 1.675 . . . . 2.3900000000000001 110.754 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -76.01 125.87 87.54 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 125.508 1.523 . . . . 1.73 110.528 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -78.76 0.84 9.63 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.73 2.287 . . . . 1.8500000000000001 113.263 177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 . . . . . 0 C--O 1.249 1.03 0 C-N-CA 125.706 1.603 . . . . 3.04 110.81 -177.145 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 118.951 -0.547 . . . . 6.0800000000000001 110.451 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -67.13 168.77 16.64 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.481 2.787 . . . . 2.8799999999999999 112.707 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.34 73.4 10.48 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 121.009 -1.057 . . . . 1.4399999999999999 111.384 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.57 -35.34 63.2 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 125.078 1.351 . . . . 2.1699999999999999 114.12 -171.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.2 m -62.47 -42.74 99.69 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 118.882 0.765 . . . . 1.9399999999999999 112.449 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.18 -31.23 38.85 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.866 1.267 . . . . 2.7400000000000002 110.141 178.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 41.2 t -69.59 -39.7 77.15 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.873 1.269 . . . . 1.6200000000000001 112.429 179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.86 -47.72 76.89 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.465 -0.772 . . . . 2.5299999999999998 111.219 171.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.43 -36.04 78.47 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.637 -0.664 . . . . 1.0600000000000001 112.541 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.5 t -55.57 -51.5 66.89 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.627 1.571 . . . . 1.3899999999999999 112.013 165.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 96.9 m -58.7 -41.23 85.81 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.147 0.979 . . . . 1.53 110.846 177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -69.4 -35.19 75.51 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.724 1.61 . . . . 5.6200000000000001 113.675 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.7 t -64.45 -47.89 77.33 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 119.558 1.072 . . . . 1.1599999999999999 111.156 171.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.97 -35.02 79.32 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.05 -1.031 . . . . 1.3300000000000001 112.261 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.68 -39.68 91.57 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.311 1.444 . . . . 2.8399999999999999 113.982 167.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.93 -43.5 94.91 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.9 1.68 . . . . 2.8300000000000001 112.549 173.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -134.18 86.97 2.32 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.132 1.373 . . . . 1.4399999999999999 113.141 -171.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 41.83 43.44 2.54 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 116.967 2.21 . . . . 3.1000000000000001 116.967 155.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.8 t80 47.55 41.86 13.87 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.403 1.481 . . . . 4.3899999999999997 114.047 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -79.19 63.32 3.81 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 125.273 2.463 . . . . 2.5499999999999998 112.774 -176.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -57.89 -10.72 1.87 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 130.455 3.502 . . . . 6.7000000000000002 114.588 173.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -89.7 -44.55 9.94 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.845 1.258 . . . . 3.3700000000000001 111.73 170.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -64.6 -41.54 96.16 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 121.0 -1.062 . . . . 3.8199999999999998 112.234 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.6 m -101.9 23.87 10.8 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.726 1.38 . . . . 0.84999999999999998 114.726 -177.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.8 p -64.1 -16.54 62.0 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.97 -1.081 . . . . 2.21 113.718 171.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 p -54.0 -45.15 71.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 128.319 2.648 . . . . 2.1800000000000002 113.956 170.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -67.36 -47.09 71.45 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.376 1.07 . . . . 2.1299999999999999 111.231 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -59.2 -39.63 83.24 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.149 0.58 . . . . 4.5700000000000003 111.184 175.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.8 tp -61.09 -47.72 85.02 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.283 1.033 . . . . 1.1399999999999999 112.498 171.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.3 ttt-85 -69.22 -24.5 64.02 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 120.889 -1.132 . . . . 5.7000000000000002 113.049 178.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -71.79 -40.44 69.22 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.908 1.283 . . . . 2.6299999999999999 110.466 172.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -65.23 -45.77 83.3 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.556 1.142 . . . . 3.8500000000000001 111.951 172.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -57.34 -45.14 84.6 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 119.417 1.008 . . . . 1.0900000000000001 112.215 175.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 9.8 t -57.38 -52.56 64.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.165 1.786 . . . . 1.6200000000000001 112.05 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -30.62 53.42 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 113.221 0.823 . . . . 4.7999999999999998 113.221 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.6 ttp-105 -60.71 -39.34 88.2 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 119.689 1.131 . . . . 4.7300000000000004 111.42 172.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.48 -56.35 21.06 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.571 0.701 . . . . 2.29 110.835 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 m95 -64.14 -32.26 73.76 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 118.647 -0.692 . . . . 0.73999999999999999 112.543 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -64.59 -36.03 82.93 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 119.74 1.155 . . . . 1.76 113.045 169.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 62.0 m -66.86 -38.9 87.23 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.508 -1.37 . . . . 1.23 112.318 170.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.88 -37.94 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.385 0.993 . . . . 0.46999999999999997 111.184 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.58 -47.83 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.094 0.958 . . . . 0.69999999999999996 110.532 170.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 96.6 mmm -65.19 -36.25 83.61 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.517 1.053 . . . . 2.3500000000000001 113.582 176.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.43 -20.8 61.35 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.982 1.313 . . . . 3.3799999999999999 113.259 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 27.0 mtt85 -85.44 -31.27 22.94 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.704 1.202 . . . . 2.4300000000000002 112.792 165.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -71.22 -18.46 62.46 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.178 1.391 . . . . 2.4399999999999999 113.17 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -54.8 -29.99 55.92 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 119.76 1.164 . . . . 1.7 113.877 169.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -98.36 -16.11 19.44 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.373 1.249 . . . . 2.0299999999999998 114.373 173.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.54 5.73 68.92 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 116.094 1.198 . . . . 1.75 116.094 164.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.3 p -107.87 -44.16 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 115.631 1.715 . . . . 2.0499999999999998 115.631 -156.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.2 ptpt -93.58 171.18 7.45 Favored Pre-proline 0 N--CA 1.48 1.053 0 C-N-CA 125.563 1.545 . . . . 2.2599999999999998 112.928 -175.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -59.83 115.05 2.35 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 N-CA-C 108.981 -1.2 . . . . 1.6599999999999999 108.981 152.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -72.64 -38.94 67.54 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.83 2.052 . . . . 2.29 112.726 -174.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 15.5 mmt -56.36 117.42 16.49 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 108.907 -0.775 . . . . 1.0700000000000001 108.907 164.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.4 147.61 59.13 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 123.068 2.512 . . . . 0.95999999999999996 113.183 -167.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 64.3 p -82.52 163.34 21.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.33 1.052 . . . . 1.1499999999999999 110.949 169.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.82 -41.54 61.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.683 1.364 . . . . 1.5700000000000001 114.683 -166.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.03 -32.56 67.26 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 113.629 0.974 . . . . 1.5800000000000001 113.629 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -66.99 -55.68 13.41 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.179 1.392 . . . . 2.23 108.425 172.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 50.2 ttm-85 -52.12 -41.53 62.56 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.964 1.306 . . . . 4.96 111.093 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -61.44 -56.8 16.16 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 124.656 1.183 . . . . 2.4700000000000002 113.153 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -65.44 -27.27 68.39 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.082 0.771 . . . . 2.5299999999999998 113.082 -177.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 34.0 mt -72.67 -47.95 48.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 124.824 1.25 . . . . 0.85999999999999999 110.105 176.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.4 mt -59.86 -32.53 70.79 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.526 -0.734 . . . . 0.84999999999999998 112.946 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 32.9 mtt85 -78.33 -27.91 47.18 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 113.976 1.102 . . . . 4.8600000000000003 113.976 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.47 -24.51 60.22 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.051 0.94 . . . . 0.97999999999999998 113.184 170.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 51.7 t -76.78 -46.07 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 O-C-N 121.06 -1.025 . . . . 0.96999999999999997 109.307 159.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 81.26 -2.15 82.68 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 127.541 2.496 . . . . 1.27 114.166 -177.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -141.26 167.91 21.03 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.816 2.046 . . . . 1.8799999999999999 109.015 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.7 tpt -59.11 123.61 70.31 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.178 0.991 . . . . 1.28 109.316 171.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_endo -74.43 2.24 6.51 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 123.297 2.664 . . . . 1.0700000000000001 112.514 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 1.2 m-30 . . . . . 0 C--O 1.254 1.312 0 C-N-CA 124.349 1.06 . . . . 2.2400000000000002 111.302 -177.088 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.8 m120 . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 109.442 -0.577 . . . . 3.2799999999999998 109.442 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -59.55 141.35 97.13 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 121.273 1.315 . . . . 1.6000000000000001 110.059 151.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.3 m -91.12 80.72 5.63 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 121.479 -0.763 . . . . 1.49 111.666 -176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.38 -29.48 66.06 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.426 0.898 . . . . 2.1499999999999999 113.426 -174.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 m -66.7 -45.8 77.63 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.146 0.885 . . . . 1.79 112.695 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.21 -29.21 54.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.716 0.807 . . . . 2.8399999999999999 110.349 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 t -69.75 -38.85 76.94 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 112.472 0.545 . . . . 1.48 112.472 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -66.19 -44.89 82.67 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.009 -1.057 . . . . 3.4300000000000002 110.983 172.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.5 -39.09 93.14 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.61 -0.681 . . . . 1.46 112.479 177.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.0 t -58.05 -50.75 72.35 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.384 1.474 . . . . 1.5800000000000001 112.455 166.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 87.2 m -56.19 -42.93 77.93 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 121.118 -0.989 . . . . 2.1200000000000001 111.047 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -71.13 -33.1 69.78 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.496 1.118 . . . . 6.4100000000000001 113.183 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.85 -46.73 89.44 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.096 1.316 . . . . 1.76 111.026 168.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -70.84 -30.75 67.25 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 120.646 -1.284 . . . . 2.3199999999999998 113.41 -176.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -77.95 -26.64 48.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 114.15 1.167 . . . . 5.4199999999999999 114.15 167.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -62.64 -56.99 12.72 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.916 1.235 . . . . 3.6699999999999999 111.786 168.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -122.81 82.39 1.98 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.171 1.389 . . . . 2.1000000000000001 112.386 -166.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 48.8 t30 47.05 37.67 5.47 Favored 'General case' 0 CA--C 1.553 1.077 0 N-CA-C 115.851 1.797 . . . . 4.2400000000000002 115.851 158.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 56.39 41.33 29.09 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.724 1.61 . . . . 3.5699999999999998 114.483 -175.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . 0.258 6.8 t0 -79.53 59.85 3.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-O 124.207 1.956 . . . . 2.02 114.385 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -59.35 -12.81 6.38 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 127.267 2.227 . . . . 4.79 114.429 174.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -75.37 -54.78 6.49 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.453 1.101 . . . . 3.2599999999999998 110.778 166.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 39.3 mmt180 -60.95 -34.55 74.9 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.918 0.887 . . . . 4.2400000000000002 112.997 178.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.1 m -101.66 15.4 29.03 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 114.906 1.447 . . . . 0.92000000000000004 114.906 176.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 m -53.59 -26.27 20.95 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 120.452 -1.405 . . . . 1.71 113.802 171.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.3 t -64.81 -33.25 75.55 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 120.773 -1.205 . . . . 2.8500000000000001 113.249 177.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -65.41 -49.57 68.76 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.81 0.844 . . . . 2.1000000000000001 110.476 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -65.22 -28.61 69.49 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.613 0.765 . . . . 4.1699999999999999 112.484 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.8 tp -66.28 -49.96 65.32 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.294 -0.879 . . . . 1.52 112.661 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -59.69 -31.36 69.5 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 119.142 0.883 . . . . 5.4900000000000002 111.638 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -68.94 -42.68 76.39 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.455 0.702 . . . . 2.5 111.328 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -53.31 54.23 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.316 1.046 . . . . 3.6899999999999999 111.404 167.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 37.6 m-20 -62.17 -37.19 84.31 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 119.014 0.825 . . . . 1.72 112.713 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -63.3 -52.88 60.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 125.992 1.717 . . . . 1.8799999999999999 112.696 174.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.61 -33.56 64.64 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.19 0.811 . . . . 7.0 113.19 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.7 ttm180 -61.72 -37.25 83.52 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.666 1.586 . . . . 4.2199999999999998 111.876 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -63.23 -57.98 8.68 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 122.324 1.059 . . . . 2.0099999999999998 110.121 -178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -67.74 -32.68 73.46 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 114.881 -1.054 . . . . 1.3899999999999999 112.971 -177.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 57.9 m-20 -63.97 -36.38 83.77 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.02 -1.05 . . . . 2.23 112.702 168.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.1 m -68.52 -37.75 80.28 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.056 -1.027 . . . . 1.6200000000000001 111.421 175.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 38.9 mm -59.12 -45.34 92.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 O-C-N 121.18 -0.95 . . . . 0.58999999999999997 110.769 170.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.9 t -58.35 -44.92 89.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 124.144 0.977 . . . . 1.1699999999999999 111.772 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.3 mmm -57.18 -47.11 82.07 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.972 1.26 . . . . 2.2799999999999998 111.956 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 -67.14 -24.24 65.89 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.564 0.746 . . . . 1.8 112.866 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 -86.49 -27.37 24.09 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.752 1.39 . . . . 2.5600000000000001 114.752 167.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.411 ' HA ' ' CE1' ' A' ' 66' ' ' PHE . 64.2 ttt180 -77.27 -26.61 52.59 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.596 1.158 . . . . 3.6400000000000001 113.99 -175.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -58.0 -20.98 42.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 115.846 1.795 . . . . 3.4700000000000002 115.846 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -106.09 2.59 27.28 Favored 'General case' 0 CA--C 1.552 1.037 0 N-CA-C 115.505 1.669 . . . . 3.8799999999999999 115.505 169.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 63.96 15.19 57.84 Favored Glycine 0 N--CA 1.482 1.729 0 CA-C-N 120.097 1.317 . . . . 1.9399999999999999 116.34 169.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.02 -34.11 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 115.696 1.739 . . . . 2.3700000000000001 115.696 -149.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.8 ptpt -139.69 174.04 4.47 Favored Pre-proline 0 N--CA 1.476 0.849 0 C-N-CA 125.334 1.454 . . . . 2.5 112.655 -163.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -60.56 115.46 2.69 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 N-CA-C 108.914 -1.225 . . . . 1.5800000000000001 108.914 155.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 59' ' ' ARG . 24.0 m-85 -75.28 -41.47 57.07 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.382 0.882 . . . . 2.5899999999999999 113.382 -168.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 5.9 mmt -57.19 114.9 9.03 Favored Pre-proline 0 CA--C 1.542 0.666 0 C-N-CA 123.37 0.668 . . . . 1.8999999999999999 110.964 171.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.7 137.27 41.61 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.075 2.517 . . . . 1.4099999999999999 113.504 -163.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 65.0 p -71.64 164.28 26.21 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.949 1.3 . . . . 1.6599999999999999 111.14 171.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.93 -35.72 69.39 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 113.872 1.064 . . . . 2.3700000000000001 113.872 -166.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.75 -36.11 70.32 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.431 0.9 . . . . 2.48 113.431 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.25 -53.61 28.46 Favored 'General case' 0 CA--C 1.526 0.03 0 C-N-CA 124.65 1.18 . . . . 2.46 108.476 173.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 45.7 ttt85 -50.9 -43.21 59.75 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.493 1.117 . . . . 3.4399999999999999 111.467 175.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.41 -56.25 22.32 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.947 0.899 . . . . 3.5800000000000001 113.26 175.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -65.42 -31.46 72.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.876 0.762 . . . . 2.96 112.369 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.51 -47.01 74.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 C-N-CA 124.331 1.052 . . . . 1.3700000000000001 110.524 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 37.7 mt -61.11 -33.64 73.69 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 120.615 -1.303 . . . . 1.6000000000000001 112.487 171.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -70.51 -23.23 62.62 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.134 0.974 . . . . 6.7400000000000002 113.475 172.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -84.49 -26.27 28.27 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.271 1.428 . . . . 1.4299999999999999 113.922 169.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.3 t -68.06 -40.71 83.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 O-C-N 120.483 -1.385 . . . . 0.95999999999999996 109.644 166.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.67 -0.39 70.88 Favored Glycine 0 CA--C 1.532 1.146 0 C-N-CA 125.556 1.551 . . . . 1.55 113.658 -178.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -152.18 -174.77 4.99 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.778 2.031 . . . . 2.9399999999999999 109.786 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -63.58 130.87 94.63 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-O 117.917 -1.04 . . . . 1.74 108.477 156.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -75.68 -2.16 12.24 Favored 'Trans proline' 0 CA--C 1.538 0.705 0 C-N-CA 123.306 2.671 . . . . 1.6100000000000001 113.064 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 25.0 p90 . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.522 1.929 . . . . 2.5099999999999998 113.675 178.723 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.479 1.011 0 CA-C-O 118.982 -0.533 . . . . 3.3100000000000001 110.239 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -59.78 164.86 10.94 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 122.843 2.362 . . . . 1.7 111.198 152.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.33 84.42 1.97 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 122.083 0.944 . . . . 1.29 113.271 -169.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -72.73 -29.97 63.8 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.07 0.948 . . . . 2.96 113.001 -171.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.7 m -66.15 -45.02 82.46 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 119.237 0.926 . . . . 2.0899999999999999 111.539 177.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.01 -30.14 62.3 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.701 0.8 . . . . 3.3399999999999999 110.902 175.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.0 t -61.31 -40.89 95.84 Favored 'General case' 0 N--CA 1.478 0.947 0 O-C-N 121.762 -0.586 . . . . 1.8200000000000001 111.435 170.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -73.29 -34.24 65.64 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.693 1.597 . . . . 2.6400000000000001 113.141 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -25.85 62.38 Favored 'General case' 0 CA--C 1.547 0.855 0 O-C-N 121.214 -0.928 . . . . 1.1699999999999999 112.174 170.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 t -68.62 -44.11 74.95 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.269 1.028 . . . . 1.5800000000000001 111.377 167.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 m -50.46 -43.81 55.44 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.933 0.788 . . . . 1.9399999999999999 110.456 167.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.4 -48.72 78.49 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.217 1.007 . . . . 8.4299999999999997 113.278 177.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.9 t -55.45 -46.02 76.82 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.664 0.745 . . . . 1.3200000000000001 111.396 173.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.56 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.3 mp -72.46 -32.66 66.43 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.035 -1.041 . . . . 1.3999999999999999 113.038 -173.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.29 -24.68 60.44 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.382 1.473 . . . . 3.1299999999999999 113.638 167.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.56 -52.1 19.94 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.019 1.328 . . . . 3.25 113.116 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.42 68.92 1.01 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.323 1.449 . . . . 1.72 112.913 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.7 m120 41.85 43.85 2.68 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 126.183 1.793 . . . . 4.0899999999999999 115.424 164.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.56 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 55.56 47.49 20.75 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 126.358 1.863 . . . . 3.1000000000000001 114.782 179.03 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -79.21 64.52 4.14 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 123.945 1.831 . . . . 2.6499999999999999 111.901 173.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -61.64 -3.66 1.14 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 126.182 1.793 . . . . 5.3399999999999999 114.951 173.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -97.54 -38.45 9.56 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.652 1.181 . . . . 3.9100000000000001 112.368 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -69.33 -52.44 27.29 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 119.022 0.828 . . . . 5.7400000000000002 110.8 165.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 12.1 m -76.89 20.66 0.24 Allowed 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 113.819 1.044 . . . . 1.5900000000000001 113.819 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.8 p -57.72 -25.16 59.97 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 120.704 -1.247 . . . . 1.8899999999999999 112.656 164.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 22.1 p -51.49 -42.6 61.79 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 127.611 2.364 . . . . 3.02 112.905 170.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -65.24 -42.33 93.44 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.012 0.925 . . . . 2.9300000000000002 112.076 177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -70.64 -27.32 63.97 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.801 -0.562 . . . . 6.0300000000000002 112.227 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.8 tp -66.08 -50.02 65.56 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.58 0.752 . . . . 1.47 112.283 164.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 81.1 mtt180 -56.09 -32.11 63.86 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 119.866 1.212 . . . . 6.2800000000000002 112.125 173.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -69.49 -44.88 70.23 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.723 0.809 . . . . 2.3700000000000001 111.417 175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -63.09 -30.51 71.65 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.108 1.151 . . . . 3.1499999999999999 114.108 169.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -65.36 -31.75 73.03 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.659 1.118 . . . . 1.45 112.041 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 27.7 m -65.52 -52.03 55.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.232 1.013 . . . . 1.76 111.707 171.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 9.8 mtm180 -61.41 -44.58 96.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 118.834 -0.603 . . . . 4.0199999999999996 112.477 178.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -53.81 -39.94 65.95 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.368 1.467 . . . . 4.4100000000000001 112.567 -178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -62.54 -59.42 4.97 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.403 0.62 . . . . 2.0499999999999998 110.87 176.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.93 -35.41 80.53 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 112.797 0.666 . . . . 0.85999999999999999 112.797 -175.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 54.0 m-20 -59.89 -39.96 87.13 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.865 1.666 . . . . 1.9299999999999999 111.741 168.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 m -66.89 -39.99 87.63 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.445 -0.784 . . . . 1.3100000000000001 112.189 173.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.0 mm -60.18 -43.18 92.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-N 120.106 1.321 . . . . 0.85999999999999999 110.717 172.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 40.8 t -59.04 -43.02 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.65 0.78 . . . . 0.76000000000000001 111.534 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.2 mmt -62.91 -39.43 94.51 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.984 1.265 . . . . 2.3300000000000001 112.959 172.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -75.73 -11.11 59.93 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.355 1.062 . . . . 1.5700000000000001 113.048 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 41.7 mtt180 -93.87 -40.55 10.1 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.381 1.472 . . . . 3.8900000000000001 113.645 164.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -65.62 -18.39 65.29 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.922 0.889 . . . . 2.5099999999999998 112.443 -173.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -55.16 -24.92 29.03 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.366 1.617 . . . . 2.21 115.366 170.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -100.98 -18.75 16.15 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.324 1.231 . . . . 2.6099999999999999 114.324 177.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.67 77.75 Favored Glycine 0 CA--C 1.54 1.614 0 N-CA-C 116.966 1.546 . . . . 1.27 116.966 172.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.7 p -118.4 -32.1 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 N-CA-C 116.825 2.157 . . . . 2.23 116.825 -151.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 ptpp? -116.54 165.4 15.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 127.211 2.204 . . . . 2.6800000000000002 111.669 -174.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -66.04 117.23 4.5 Favored 'Trans proline' 0 C--N 1.349 0.605 0 CA-C-N 121.054 1.412 . . . . 1.47 109.069 166.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -70.68 -55.57 8.41 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 123.744 0.818 . . . . 2.2200000000000002 111.713 -171.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.53 110.95 2.71 Favored Pre-proline 0 CA--C 1.54 0.563 0 C-N-CA 125.191 1.396 . . . . 1.01 110.498 176.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -67.9 139.09 46.37 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.327 2.018 . . . . 0.88 113.335 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 52.7 p -79.7 170.37 16.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.625 2.37 . . . . 1.3300000000000001 110.586 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.93 -44.31 74.16 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.303 1.594 . . . . 1.53 115.303 -164.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.94 -25.96 60.24 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.477 -0.764 . . . . 1.52 112.882 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -71.97 -50.88 25.15 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.188 0.995 . . . . 2.46 108.444 173.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -51.87 -39.81 59.56 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 118.516 -0.754 . . . . 3.3799999999999999 112.097 171.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.73 -54.84 33.12 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.521 0.601 . . . . 2.7999999999999998 112.391 175.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -66.92 -27.51 67.55 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 113.566 0.95 . . . . 2.2599999999999998 113.566 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.2 mt -76.62 -45.3 33.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 124.5 1.12 . . . . 1.0 110.826 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.5 mt -61.67 -33.22 73.6 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 120.692 -1.255 . . . . 1.1899999999999999 112.132 171.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -66.22 -38.51 88.12 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.154 0.982 . . . . 6.4699999999999998 112.304 169.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.74 -28.03 64.4 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.298 1.039 . . . . 1.21 112.852 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 57.3 t -75.69 -39.73 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.573 0.749 . . . . 1.1899999999999999 110.202 166.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.44 1.41 75.94 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 125.236 1.398 . . . . 1.54 113.394 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -154.45 175.53 13.47 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.547 1.939 . . . . 1.99 109.176 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.3 tpt -67.21 127.86 93.6 Favored Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 123.993 0.917 . . . . 1.4399999999999999 110.059 169.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -77.22 4.38 5.9 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 123.074 2.516 . . . . 1.22 112.992 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 24.9 p90 . . . . . 0 C--O 1.253 1.257 0 C-N-CA 126.36 1.864 . . . . 2.48 114.697 177.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 118.76 -0.638 . . . . 3.1200000000000001 109.433 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -56.39 132.22 50.52 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 N-CA-C 108.564 -1.36 . . . . 2.1000000000000001 108.564 152.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.0 m -80.97 79.86 7.56 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.461 -0.774 . . . . 1.3700000000000001 112.039 -174.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -50.59 -26.54 5.44 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.188 1.395 . . . . 2.6400000000000001 112.653 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.7 m -63.45 -51.59 65.01 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.726 1.61 . . . . 2.2000000000000002 112.789 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -67.86 -31.62 71.56 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 121.53 -0.731 . . . . 2.5099999999999998 110.936 171.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -69.58 -35.01 74.95 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.756 -0.59 . . . . 1.78 112.494 -178.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -69.34 -41.97 75.92 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.485 1.914 . . . . 2.5699999999999998 112.525 176.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.58 -38.42 62.65 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.171 -0.956 . . . . 1.0700000000000001 112.611 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 p -63.64 -33.47 75.7 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 120.816 -1.178 . . . . 1.6200000000000001 111.972 168.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.4 m -60.8 -40.81 94.05 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.69 1.132 . . . . 1.26 111.266 169.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -59.15 -47.73 84.22 Favored 'General case' 0 N--CA 1.487 1.39 0 CA-C-N 119.452 1.024 . . . . 4.5700000000000003 112.481 170.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 2.2 t -57.46 -50.32 73.43 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.613 0.765 . . . . 1.3300000000000001 111.926 175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mp -63.28 -36.09 82.53 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.72 1.208 . . . . 1.53 112.664 -176.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.82 -35.22 78.22 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.334 1.854 . . . . 3.0600000000000001 113.386 169.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.39 -49.59 53.93 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.602 1.561 . . . . 3.8700000000000001 114.724 177.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -123.3 42.2 3.27 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.823 1.046 . . . . 1.6599999999999999 113.823 -161.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.7 t30 44.01 56.52 4.68 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.28 1.432 . . . . 3.9399999999999999 113.701 -178.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.3 t80 60.37 50.48 6.05 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 116.316 1.969 . . . . 3.0699999999999998 116.316 171.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -79.87 65.83 5.15 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 123.613 1.673 . . . . 2.2799999999999998 111.965 176.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -55.47 -9.31 0.46 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 127.474 2.31 . . . . 5.4699999999999998 114.92 171.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -93.91 -48.28 6.34 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.165 0.986 . . . . 3.5499999999999998 111.872 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -65.37 -25.47 67.59 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 119.516 1.053 . . . . 5.3899999999999997 112.723 169.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 82.6 m -107.02 26.56 9.97 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.91 1.284 . . . . 1.0700000000000001 113.197 173.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.4 p -71.11 -23.6 62.13 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.266 1.026 . . . . 2.7999999999999998 113.594 171.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 p -58.88 -42.99 90.79 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.998 1.719 . . . . 2.2799999999999998 112.2 176.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -58.66 -49.19 78.46 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.54 1.536 . . . . 2.0899999999999999 110.706 172.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.46 -40.35 86.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.737 1.215 . . . . 5.7800000000000002 112.392 175.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.14 -53.19 58.82 Favored 'General case' 0 N--CA 1.453 -0.298 0 O-C-N 121.415 -0.803 . . . . 1.2 111.035 177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 89.0 mtt-85 -67.64 -23.13 65.31 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 119.906 -0.718 . . . . 6.2800000000000002 112.39 176.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -64.74 -43.8 92.19 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.748 0.819 . . . . 2.1499999999999999 111.773 174.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -78.04 -28.22 48.96 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 114.082 1.142 . . . . 2.9300000000000002 114.082 171.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -61.0 -36.84 80.54 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.688 1.131 . . . . 1.05 111.246 171.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.2 m -55.51 -49.83 71.55 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 118.557 0.617 . . . . 1.46 111.292 172.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -65.15 -43.83 90.53 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 117.644 -1.17 . . . . 4.1399999999999997 111.874 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 38.7 ttm105 -57.77 -50.31 73.67 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.467 1.03 . . . . 3.7200000000000002 112.824 177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -58.12 -54.86 42.14 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 122.165 0.983 . . . . 2.0 111.495 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -70.34 -25.97 63.54 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 115.449 -0.796 . . . . 0.82999999999999996 112.152 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -65.09 -37.27 86.97 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.933 1.242 . . . . 1.4399999999999999 112.566 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.7 m -64.1 -43.78 94.29 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.449 0.568 . . . . 1.1699999999999999 110.861 171.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.5 mm -61.86 -38.79 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 O-C-N 121.37 -0.831 . . . . 0.53000000000000003 111.368 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 39.6 t -59.28 -46.53 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.071 0.948 . . . . 0.60999999999999999 111.418 172.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 82.4 mtp -62.45 -39.49 93.54 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 120.339 1.427 . . . . 3.0299999999999998 112.95 174.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.38 -19.8 60.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.175 1.79 . . . . 3.1600000000000001 112.946 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -81.35 -48.16 12.33 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.097 1.359 . . . . 2.9500000000000002 111.751 163.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.0 ttt180 -66.35 -18.01 65.11 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.444 1.098 . . . . 3.3799999999999999 113.814 -166.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.6 pttt -47.77 -26.95 1.78 Allowed 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.748 1.388 . . . . 2.1499999999999999 114.748 163.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -89.42 -23.33 22.17 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.965 1.098 . . . . 2.3300000000000001 113.965 176.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 70.73 6.53 59.5 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 125.814 1.673 . . . . 1.4099999999999999 116.892 170.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.7 p -112.09 -27.06 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 N-CA-C 115.405 1.631 . . . . 2.1200000000000001 115.405 -154.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -119.35 174.53 2.73 Favored Pre-proline 0 N--CA 1.476 0.839 0 C-N-CA 126.835 2.054 . . . . 2.2999999999999998 112.186 -165.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -61.25 125.43 16.93 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.345 1.363 . . . . 1.8300000000000001 110.247 154.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -84.23 -41.28 17.1 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.905 1.076 . . . . 2.1899999999999999 113.905 -170.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.6 mmt -56.46 114.26 7.43 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.345 0.658 . . . . 0.95999999999999996 110.04 165.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.93 160.86 48.12 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.633 2.889 . . . . 0.90000000000000002 113.452 -166.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.9 p -96.19 161.32 14.0 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.513 1.525 . . . . 1.1499999999999999 112.459 -175.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.74 -42.05 67.75 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 115.148 1.536 . . . . 1.28 115.148 -164.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.94 -31.65 70.69 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.726 0.81 . . . . 1.3300000000000001 113.07 175.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.415 ' HA ' ' HG2' ' A' ' 75' ' ' GLU . 39.6 mt-10 -71.01 -47.9 56.1 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.535 -0.728 . . . . 2.6899999999999999 109.39 173.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.7 mtp85 -53.68 -40.71 66.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.558 0.743 . . . . 4.3899999999999997 110.966 176.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -62.14 -55.53 27.88 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.843 1.257 . . . . 2.02 113.55 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HG2' ' HA ' ' A' ' 72' ' ' GLU . 10.0 pt-20 -62.27 -32.85 73.62 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 120.087 1.312 . . . . 2.04 113.03 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 47.2 mt -70.09 -49.52 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.763 1.625 . . . . 0.81999999999999995 110.242 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.8 -33.57 75.96 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.032 0.533 . . . . 0.88 112.222 176.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 79.7 mtt-85 -64.73 -37.46 87.69 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.155 0.582 . . . . 4.1399999999999997 112.356 169.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.51 -20.12 57.26 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 114.044 1.128 . . . . 1.04 114.044 177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.0 t -76.13 -39.3 35.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.088 0.955 . . . . 0.93999999999999995 109.921 162.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 77.33 -0.09 69.9 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 125.298 1.428 . . . . 1.1200000000000001 113.974 178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -150.44 -174.61 4.8 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.939 2.095 . . . . 1.6200000000000001 109.176 175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -74.13 123.33 89.13 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.788 1.235 . . . . 1.3100000000000001 109.155 166.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -74.16 -5.81 17.53 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.35 2.033 . . . . 1.3500000000000001 113.426 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 . . . . . 0 C--O 1.248 0.975 0 C-N-CA 126.722 2.009 . . . . 3.1000000000000001 111.183 -172.37 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 118.806 -0.616 . . . . 3.3199999999999998 109.958 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -63.91 138.37 62.59 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 122.145 1.897 . . . . 1.6699999999999999 109.801 168.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 54.6 m -91.39 58.37 3.59 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.454 -0.778 . . . . 1.1200000000000001 112.727 -164.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.23 -23.11 45.86 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 115.022 1.49 . . . . 2.7000000000000002 115.022 -174.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.7 m -70.08 -40.31 75.08 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.07 -1.019 . . . . 2.0800000000000001 111.795 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -68.71 -33.12 73.41 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.567 0.747 . . . . 2.2000000000000002 110.235 169.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.5 m -63.9 -48.36 76.94 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.095 -0.478 . . . . 1.7 111.327 175.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -61.23 -45.91 92.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 119.093 0.861 . . . . 4.8899999999999997 111.769 174.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.14 -39.8 95.72 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 118.901 0.773 . . . . 1.4099999999999999 112.39 -178.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -66.3 -37.93 86.57 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 114.698 1.37 . . . . 1.74 114.698 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.8 m -61.6 -41.74 97.87 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 120.306 1.412 . . . . 1.8200000000000001 110.717 174.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -62.99 -43.67 98.14 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.688 1.595 . . . . 5.2800000000000002 111.636 170.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.9 t -58.78 -49.92 75.86 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.804 0.729 . . . . 1.51 112.128 175.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.486 HD23 ' CE1' ' A' ' 32' ' ' TYR . 4.9 mp -66.41 -35.44 80.33 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.893 -1.129 . . . . 1.46 111.972 -177.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -64.62 -32.14 73.66 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 125.426 1.49 . . . . 3.6099999999999999 114.195 166.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.78 -55.33 5.95 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 127.275 2.23 . . . . 3.5299999999999998 113.083 177.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -121.36 53.71 1.15 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.639 1.576 . . . . 1.6599999999999999 111.831 -161.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 48.07 50.23 16.28 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.37 1.468 . . . . 3.6200000000000001 113.153 169.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER 55.92 46.64 21.65 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.359 1.615 . . . . 3.2400000000000002 115.359 174.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -74.7 66.79 1.5 Allowed 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 123.846 1.784 . . . . 3.4100000000000001 111.784 174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -63.32 -1.35 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.564 1.945 . . . . 5.9800000000000004 114.806 172.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -100.06 -40.46 7.61 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.886 1.221 . . . . 4.8700000000000001 112.221 175.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 77.1 mtt180 -67.97 -50.79 53.67 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.919 1.236 . . . . 7.2800000000000002 111.349 163.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 96.3 m -85.38 23.18 1.36 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 113.517 0.932 . . . . 1.5900000000000001 113.517 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 98.8 p -65.81 -26.64 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 118.821 -0.609 . . . . 3.02 111.349 156.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 16.5 p -46.25 -49.67 16.97 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.968 1.707 . . . . 3.0699999999999998 113.361 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -63.78 -44.39 93.51 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 125.309 1.443 . . . . 2.8799999999999999 112.417 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' CZ ' ' HE3' ' A' ' 45' ' ' LYS . 10.5 t80 -72.29 -29.87 64.28 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.405 0.682 . . . . 4.2599999999999998 112.006 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 16.6 tp -66.43 -53.49 34.94 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 125.724 1.609 . . . . 1.3700000000000001 110.463 170.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 62.9 mtp85 -56.08 -32.48 64.17 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.654 0.781 . . . . 5.0099999999999998 112.102 171.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -72.71 -45.92 56.27 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.827 0.851 . . . . 2.1000000000000001 111.352 178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.485 ' HE3' ' CZ ' ' A' ' 41' ' ' PHE . 81.9 mttt -63.64 -28.91 70.24 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 118.875 0.761 . . . . 3.0899999999999999 111.752 169.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 43.1 m-20 -69.94 -39.93 75.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.872 1.215 . . . . 1.04 111.871 170.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 77.3 m -58.43 -52.78 64.18 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-N 119.779 1.172 . . . . 1.4299999999999999 109.036 173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 -58.77 -51.68 68.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 117.952 -1.023 . . . . 3.96 111.359 179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.0 ttp-105 -62.58 -43.19 99.42 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.261 1.024 . . . . 4.9100000000000001 112.378 -178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -59.13 -58.96 6.33 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 123.067 0.547 . . . . 1.9099999999999999 110.182 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -69.17 -28.37 66.35 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 118.243 -0.884 . . . . 0.75 112.793 -174.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.84 -42.16 99.63 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 120.134 1.334 . . . . 3.2599999999999998 111.981 167.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.4 m -67.36 -37.63 83.51 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.452 -0.794 . . . . 1.4099999999999999 111.84 176.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.2 mm -66.74 -39.14 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 C-N-CA 124.506 1.122 . . . . 0.63 110.981 171.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 9.8 t -56.78 -46.62 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 124.695 1.198 . . . . 0.57999999999999996 110.352 170.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 77.8 mtm -59.06 -41.48 88.02 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 120.244 1.384 . . . . 4.5199999999999996 112.319 171.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -70.36 -21.64 62.86 Favored 'General case' 0 N--CA 1.473 0.692 0 O-C-N 121.406 -0.809 . . . . 1.47 112.818 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -82.14 -42.76 18.66 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.752 1.16 . . . . 3.46 111.27 166.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 52.4 ttt180 -71.88 -12.72 61.41 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.621 1.568 . . . . 3.1899999999999999 114.024 -169.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -55.03 -25.93 33.82 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.613 1.165 . . . . 1.99 113.743 163.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -89.03 -17.57 29.09 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.942 0.897 . . . . 2.5899999999999999 113.233 176.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 73.43 6.69 71.06 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 125.87 1.7 . . . . 1.4399999999999999 116.623 170.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.43 -41.26 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 N-CA-C 116.486 2.032 . . . . 2.3799999999999999 116.486 -155.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -86.42 170.04 13.59 Favored Pre-proline 0 N--CA 1.476 0.874 0 C-N-CA 124.24 1.016 . . . . 2.7999999999999998 112.884 -173.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -60.44 114.48 2.14 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 121.028 1.152 . . . . 1.6599999999999999 109.15 154.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -74.65 -40.76 61.26 Favored 'General case' 0 N--CA 1.466 0.367 0 O-C-N 121.493 -0.755 . . . . 2.4199999999999999 112.939 -165.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.0 mmt -56.92 118.79 25.72 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 123.874 0.87 . . . . 1.05 110.493 167.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.26 148.3 61.55 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.815 2.343 . . . . 1.1399999999999999 113.981 -170.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 68.3 p -81.54 170.48 15.82 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.447 2.299 . . . . 1.3899999999999999 111.042 175.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.68 -38.81 72.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.766 -1.209 . . . . 1.6499999999999999 114.158 -171.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.47 -32.39 58.35 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.483 0.92 . . . . 1.52 113.483 177.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.58 -53.68 43.98 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 108.295 -1.002 . . . . 2.9900000000000002 108.295 170.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.1 mtp85 -48.78 -47.08 42.27 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.652 1.181 . . . . 3.6400000000000001 111.599 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -59.04 -55.27 37.28 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.088 0.955 . . . . 2.5499999999999998 112.447 177.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -67.13 -29.17 68.83 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 113.961 1.097 . . . . 2.3900000000000001 113.961 -178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.2 mt -71.09 -44.98 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 124.935 1.294 . . . . 1.01 109.853 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.415 ' CD2' ' HD3' ' A' ' 84' ' ' PRO . 53.1 mt -61.29 -34.9 75.96 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.815 0.846 . . . . 1.1499999999999999 111.923 170.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 mmt85 -66.27 -36.75 83.79 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 122.039 -0.413 . . . . 4.3399999999999999 111.71 173.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.86 -29.58 64.53 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.937 1.088 . . . . 1.3799999999999999 113.937 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -67.58 -38.55 80.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 O-C-N 120.938 -1.101 . . . . 1.3799999999999999 109.798 164.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 82.32 1.58 90.44 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 125.607 1.575 . . . . 1.4199999999999999 113.485 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -159.78 176.85 11.46 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 128.819 2.848 . . . . 1.75 108.55 176.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.9 tpt -61.44 128.82 90.45 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 109.973 169.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.415 ' HD3' ' CD2' ' A' ' 77' ' ' LEU . 57.0 Cg_endo -74.54 -3.57 14.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.696 2.931 . . . . 1.01 112.367 -179.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--O 1.253 1.246 0 C-N-CA 124.429 1.091 . . . . 2.8399999999999999 111.387 -174.523 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 118.614 -0.708 . . . . 3.6400000000000001 110.083 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -76.86 170.71 19.31 Favored 'Trans proline' 0 CA--C 1.54 0.785 0 C-N-CA 123.576 2.851 . . . . 1.46 110.9 164.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.7 m -106.23 87.97 2.68 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.904 0.881 . . . . 1.1899999999999999 111.491 -178.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.57 -36.26 73.51 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.705 0.802 . . . . 2.3100000000000001 112.629 -174.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.3 m -71.16 -42.56 68.95 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.43 0.692 . . . . 2.3900000000000001 111.604 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -66.48 -28.12 68.33 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 121.756 -0.59 . . . . 2.6800000000000002 110.92 171.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.8 m -69.22 -35.04 75.77 Favored 'General case' 0 N--CA 1.484 1.251 0 O-C-N 121.372 -0.83 . . . . 1.74 112.979 171.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.55 -37.57 82.87 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 120.844 -1.16 . . . . 3.02 110.924 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.86 -46.41 89.54 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.834 -1.167 . . . . 0.94999999999999996 112.587 173.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.8 t -51.92 -48.11 64.35 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.809 0.843 . . . . 1.3400000000000001 112.573 167.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 93.5 m -60.51 -45.57 93.32 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.867 1.267 . . . . 1.26 111.937 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 24.3 mtt180 -64.37 -41.34 96.77 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.177 1.791 . . . . 4.6600000000000001 111.713 177.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -59.53 -48.98 79.53 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.902 0.881 . . . . 1.1000000000000001 111.422 175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD23 ' CE1' ' A' ' 32' ' ' TYR . 3.6 mp -65.74 -41.14 92.54 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.846 0.684 . . . . 1.45 112.846 -178.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -59.53 -37.71 79.1 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.827 1.251 . . . . 2.6699999999999999 113.08 169.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.38 -51.05 61.1 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.963 1.305 . . . . 3.1099999999999999 112.869 177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.57 72.92 0.86 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.631 1.172 . . . . 1.46 112.54 -170.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 42.79 43.38 3.39 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 125.427 1.491 . . . . 3.4300000000000002 115.015 166.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.478 ' CE1' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 52.04 42.41 30.4 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.281 1.832 . . . . 2.6200000000000001 114.93 -177.328 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -77.36 61.71 2.24 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 123.547 1.641 . . . . 2.3999999999999999 113.09 -177.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -53.2 -24.55 11.23 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 128.374 2.67 . . . . 5.7400000000000002 114.985 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.89 -50.97 12.08 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.249 1.02 . . . . 2.77 110.394 175.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -66.68 -26.12 66.88 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.554 0.946 . . . . 6.5 113.554 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -103.44 23.54 12.41 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.327 1.232 . . . . 1.05 114.327 169.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 25.7 m -67.09 -13.93 62.41 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 120.645 -1.284 . . . . 1.99 113.013 167.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 28.1 p -52.28 -46.36 65.86 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.266 1.426 . . . . 2.1499999999999999 112.523 169.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -67.17 -43.46 82.17 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.033 0.933 . . . . 2.9100000000000001 112.322 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -60.15 -40.94 91.64 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 122.411 0.284 . . . . 4.1900000000000004 111.428 177.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.7 tp -62.55 -48.17 80.67 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 125.45 1.5 . . . . 1.0600000000000001 112.627 171.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.2 mtp-105 -69.13 -22.08 63.98 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 120.911 -1.118 . . . . 4.6600000000000001 113.268 178.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -74.41 -42.83 58.55 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.728 0.811 . . . . 2.1499999999999999 110.835 170.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 70.6 tttt -55.87 -49.4 73.47 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.426 1.09 . . . . 4.6200000000000001 111.012 167.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -57.35 -42.36 81.84 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.603 1.161 . . . . 1.0600000000000001 111.916 176.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.4 t -59.57 -56.87 16.5 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 125.335 1.454 . . . . 1.9199999999999999 112.035 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.281 0.9 OUTLIER -68.94 -35.2 76.51 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.212 0.819 . . . . 6.8399999999999999 113.212 176.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 ttt85 -62.7 -34.57 77.41 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 119.672 1.124 . . . . 4.8700000000000001 112.208 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.16 -57.14 10.41 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.873 0.76 . . . . 2.1499999999999999 110.21 178.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -67.68 -34.39 76.81 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.827 -0.624 . . . . 0.92000000000000004 112.475 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -64.59 -30.73 71.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 120.882 -1.136 . . . . 1.8700000000000001 113.209 168.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.1 m -70.18 -41.83 73.24 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 118.335 -0.841 . . . . 1.5800000000000001 111.825 170.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.48 -41.61 82.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 CA-C-N 120.597 1.544 . . . . 0.76000000000000001 110.525 172.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 49.1 t -57.45 -50.93 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 123.773 0.829 . . . . 0.79000000000000004 111.169 171.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 17.0 mmt -58.5 -42.77 88.4 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 120.179 1.354 . . . . 2.4300000000000002 112.836 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -75.34 -17.62 60.2 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.383 1.073 . . . . 1.53 112.486 -177.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.434 HH22 ' CD ' ' A' ' 72' ' ' GLU . 46.7 mtt180 -85.91 -36.71 19.74 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.975 0.91 . . . . 4.04 112.821 163.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -72.24 -11.6 60.79 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.653 1.581 . . . . 2.6699999999999999 113.534 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -56.8 -29.94 63.22 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.353 1.061 . . . . 2.1200000000000001 112.802 162.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.9 m-80 -99.74 -25.81 14.26 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 114.361 1.245 . . . . 2.4399999999999999 114.361 179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 72.82 16.26 78.1 Favored Glycine 0 CA--C 1.545 1.956 0 N-CA-C 117.288 1.675 . . . . 1.29 117.288 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.6 p -122.01 -13.19 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 116.242 1.941 . . . . 2.3199999999999998 116.242 -157.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -139.76 172.76 5.89 Favored Pre-proline 0 N--CA 1.477 0.903 0 C-N-CA 126.428 1.891 . . . . 2.0600000000000001 113.435 -164.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -63.0 107.61 0.66 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 121.543 1.495 . . . . 1.78 110.926 164.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -66.36 -47.5 73.23 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 126.227 1.811 . . . . 1.8799999999999999 112.065 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 12.3 mmt -66.18 112.29 8.74 Favored Pre-proline 0 CA--C 1.543 0.689 0 C-N-CA 123.278 0.631 . . . . 1.2 109.561 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.91 162.22 42.43 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 123.541 2.827 . . . . 1.1399999999999999 113.539 -171.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 13.3 p -92.75 168.1 11.42 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.802 0.841 . . . . 1.3 111.275 173.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.38 95.82 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.626 1.343 . . . . 1.25 114.626 -162.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.24 -30.16 70.54 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.416 1.086 . . . . 1.46 112.651 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.434 ' CD ' HH22 ' A' ' 58' ' ' ARG . 32.3 mt-10 -73.2 -50.64 21.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.441 1.096 . . . . 2.3100000000000001 108.669 176.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.3 mtp-105 -50.24 -41.69 50.6 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 118.816 0.735 . . . . 3.5499999999999998 111.696 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -64.07 -52.29 60.03 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.88 0.696 . . . . 2.79 112.88 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.09 -26.29 65.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.657 0.984 . . . . 2.27 113.657 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 41.1 mt -73.47 -47.2 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 C-N-CA 125.051 1.34 . . . . 0.77000000000000002 109.854 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.91 -36.81 77.77 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.532 -0.73 . . . . 0.81999999999999995 111.963 171.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.8 mtt-85 -74.8 -22.79 58.53 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.243 0.831 . . . . 5.5300000000000002 113.243 175.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.7 -33.52 58.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.355 1.062 . . . . 0.93000000000000005 112.571 168.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.6 t -66.68 -38.45 81.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 121.314 -0.866 . . . . 0.85999999999999999 109.769 165.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 74.49 4.28 69.27 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 125.417 1.485 . . . . 1.01 112.456 179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -151.8 173.84 14.28 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.884 2.074 . . . . 2.25 109.427 -172.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.27 130.63 82.02 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 124.122 0.969 . . . . 1.1899999999999999 109.843 170.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -83.76 0.18 9.45 Favored 'Trans proline' 0 C--N 1.349 0.605 0 C-N-CA 122.379 2.053 . . . . 1.24 112.927 173.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 4.5 m-30 . . . . . 0 C--O 1.253 1.271 0 C-N-CA 126.92 2.088 . . . . 2.8199999999999998 111.996 -171.534 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 . . . . . 0 N--CA 1.477 0.892 0 CA-C-O 119.396 -0.335 . . . . 4.6399999999999997 111.648 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -71.33 166.33 29.62 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.908 2.405 . . . . 1.8 110.982 151.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -113.38 77.27 1.04 Allowed 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 124.191 0.996 . . . . 1.23 111.669 175.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.35 -26.28 64.93 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 120.886 -1.134 . . . . 2.8199999999999998 113.527 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.5 m -74.58 -40.58 61.53 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.373 1.469 . . . . 2.0899999999999999 113.027 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.17 -31.62 70.37 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.58 0.752 . . . . 3.04 110.377 169.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.0 t -67.59 -37.13 82.13 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.706 0.802 . . . . 1.8200000000000001 111.93 174.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -64.54 -43.52 93.72 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 120.491 -1.381 . . . . 2.6499999999999999 111.543 169.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -32.78 73.54 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 121.177 -0.952 . . . . 1.1200000000000001 112.958 177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 p -67.24 -42.49 83.9 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.638 1.175 . . . . 1.6499999999999999 111.182 169.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.0 m -58.87 -40.53 84.61 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.748 0.819 . . . . 1.26 110.066 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -65.01 -39.55 93.58 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.743 1.217 . . . . 6.6500000000000004 113.417 173.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.9 t -61.53 -44.59 96.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 119.34 0.973 . . . . 1.1899999999999999 112.669 169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -74.13 -27.51 60.89 Favored 'General case' 0 C--N 1.327 -0.409 0 O-C-N 120.807 -1.183 . . . . 1.3400000000000001 113.335 -173.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -63.31 -49.69 72.99 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.222 1.409 . . . . 3.2999999999999998 111.755 159.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -58.99 -39.45 81.82 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.972 1.471 . . . . 4.5999999999999996 114.972 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.49 69.08 1.44 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.488 1.515 . . . . 1.46 112.442 -174.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.8 t30 32.53 57.51 0.4 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.477 2.311 . . . . 3.0 114.703 167.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . 0.272 0.1 OUTLIER 55.74 32.49 19.53 Favored 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 117.603 2.446 . . . . 3.6800000000000002 117.603 174.658 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -74.17 63.38 0.99 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.726 1.61 . . . . 2.3399999999999999 112.526 177.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -60.96 -8.1 2.93 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.781 1.632 . . . . 5.8899999999999997 114.537 177.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -88.07 -48.97 7.33 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.854 0.861 . . . . 3.23 111.771 169.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 76.5 mtt85 -68.07 -18.13 64.58 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 120.022 1.283 . . . . 3.7999999999999998 114.074 172.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 1.4 m -107.75 21.09 17.94 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.124 1.157 . . . . 0.89000000000000001 114.124 164.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -60.5 -21.31 62.29 Favored 'General case' 0 N--CA 1.478 0.925 0 O-C-N 120.984 -1.073 . . . . 1.8500000000000001 113.625 173.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 83.0 m -53.89 -32.36 53.02 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.479 1.112 . . . . 2.46 112.554 171.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -71.81 -46.95 56.5 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.518 -0.738 . . . . 2.1000000000000001 111.211 177.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -59.07 -40.21 84.48 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.668 0.387 . . . . 5.25 111.511 171.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 27.4 tp -60.25 -55.39 34.33 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.112 0.965 . . . . 1.1000000000000001 111.549 175.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -59.99 -30.85 69.41 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.709 0.686 . . . . 4.6699999999999999 112.231 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 46.1 t80 -69.04 -40.06 78.8 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.938 0.895 . . . . 2.1200000000000001 111.217 178.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -77.49 -23.05 50.39 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 121.12 -0.988 . . . . 4.6399999999999997 112.84 171.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -68.38 -34.9 76.87 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.956 -1.09 . . . . 1.1899999999999999 111.31 168.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 61.9 m -58.25 -50.97 71.69 Favored 'General case' 0 C--N 1.348 0.535 0 C-N-CA 123.932 0.893 . . . . 1.47 110.281 168.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -54.32 -55.36 29.21 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 118.012 -0.994 . . . . 4.21 110.518 176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -59.57 -39.43 84.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.99 1.316 . . . . 4.7400000000000002 113.091 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -61.78 -58.16 9.08 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.678 0.672 . . . . 2.0699999999999998 110.908 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -70.7 -28.69 64.94 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.998 -0.546 . . . . 0.73999999999999999 111.874 -174.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -65.7 -34.88 79.23 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.106 1.362 . . . . 1.4099999999999999 112.214 167.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.3 m -67.88 -39.27 83.71 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.302 -0.874 . . . . 1.1799999999999999 111.449 172.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 46.7 mm -62.47 -42.32 95.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 119.106 0.867 . . . . 0.45000000000000001 110.948 172.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -57.2 -49.89 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 124.04 0.936 . . . . 0.59999999999999998 110.911 172.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.0 mmt -63.07 -35.27 79.7 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 119.541 1.064 . . . . 1.9199999999999999 113.72 177.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 89.6 mm-40 -74.32 -26.29 60.07 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.982 0.913 . . . . 1.72 113.179 177.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 72' ' ' GLU . 32.8 mtt180 -82.02 -35.22 29.05 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.427 -0.795 . . . . 4.2699999999999996 112.64 167.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -66.39 -24.1 66.43 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.782 1.633 . . . . 3.21 113.187 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 41.0 pttt -53.1 -30.7 37.96 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.945 1.091 . . . . 1.8899999999999999 113.945 171.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -99.09 -10.02 23.1 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 114.45 1.278 . . . . 2.0499999999999998 114.45 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 71.58 3.98 56.02 Favored Glycine 0 CA--C 1.541 1.694 0 N-CA-C 117.566 1.786 . . . . 1.4299999999999999 117.566 170.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.467 HG13 ' H ' ' A' ' 64' ' ' LYS . 2.5 p -105.36 -75.92 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 125.002 1.321 . . . . 2.1899999999999999 114.511 -156.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.467 ' H ' HG13 ' A' ' 63' ' ' VAL . 1.2 ptpp? -69.32 170.9 7.8 Favored Pre-proline 0 N--CA 1.476 0.866 0 C-N-CA 127.277 2.231 . . . . 2.0 113.408 -177.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -57.72 119.05 6.06 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.059 1.839 . . . . 1.6599999999999999 111.74 163.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -71.78 -49.44 38.88 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 123.938 0.895 . . . . 2.1000000000000001 111.76 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.9 mmt -67.77 109.78 4.39 Favored Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 123.861 0.864 . . . . 0.93000000000000005 109.868 167.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.35 150.78 53.12 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 123.86 3.04 . . . . 1.05 114.205 -167.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.5 p -80.23 173.64 12.4 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.434 1.494 . . . . 1.55 111.477 174.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.74 83.56 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.112 -1.618 . . . . 1.5600000000000001 115.172 -169.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.89 -24.11 59.66 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.031 0.752 . . . . 1.6699999999999999 113.031 175.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 58' ' ' ARG . 59.5 mt-10 -75.72 -49.74 17.37 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.044 -1.035 . . . . 3.2799999999999998 109.276 174.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 62.6 mtm-85 -49.43 -41.14 39.03 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.973 1.309 . . . . 5.5499999999999998 110.991 169.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.06 -53.98 41.39 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.108 0.781 . . . . 2.1800000000000002 113.108 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.14 -24.2 64.98 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.446 1.021 . . . . 2.2400000000000002 113.703 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 44.7 mt -78.26 -41.84 26.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.362 1.065 . . . . 0.93000000000000005 109.965 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.3 mt -61.23 -35.09 76.28 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.683 -1.261 . . . . 0.87 111.957 168.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -64.38 -36.02 82.78 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 119.267 -0.397 . . . . 5.5199999999999996 111.806 169.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.82 -22.89 62.28 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.936 1.088 . . . . 1.3700000000000001 113.936 174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.47 -42.72 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 119.916 1.235 . . . . 1.02 110.015 164.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.74 -3.24 56.62 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 124.851 1.215 . . . . 1.0700000000000001 114.004 -177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -150.98 -175.13 5.02 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.439 2.295 . . . . 2.4700000000000002 109.312 173.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.1 tpt -69.96 129.24 91.09 Favored Pre-proline 0 CA--C 1.545 0.784 0 O-C-N 120.867 -1.145 . . . . 1.3100000000000001 109.43 170.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -74.39 -5.25 16.66 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.456 2.104 . . . . 1.0900000000000001 112.664 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 10.9 p90 . . . . . 0 C--O 1.25 1.123 0 C-N-CA 126.285 1.834 . . . . 2.7999999999999998 112.285 177.72 . . . . . . . . 0 0 . 1 stop_ save_