data_2lch_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 2lch _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 ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.654 0.264 . . . . 75.11 111.442 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 74.53 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.542 ' HZ1' ' HB3' ' A' ' 10' ' ' LYS . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 75.05 111.388 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 74.0 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.427 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.21 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.3 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.1 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.427 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.21 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.14 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.431 ' HA ' HD12 ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 73.01 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD13 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 71.31 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 73.15 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.43 111.702 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.467 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.52 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.442 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 71.22 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 70.14 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.34 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.425 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 73.52 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.41 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.34 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.537 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 74.35 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 75.11 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.15 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 73.54 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.41 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.468 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.34 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.52 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.02 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 71.33 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.33 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.537 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.44 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 71.4 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.42 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.11 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 63.41 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 74.31 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.23 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.665 HG13 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.12 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.41 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 72.03 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 75.52 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.4 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 74.22 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.24 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 74.45 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 74.23 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 64.31 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.11 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.404 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 73.43 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 74.15 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 74.4 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.694 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 73.35 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.44 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.458 ' O ' HG21 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 74.45 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.58 HD13 HG11 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 72.45 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.43 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 75.4 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.665 ' HB ' HG13 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.13 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 72.21 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 74.42 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 72.05 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.32 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 64.3 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.42 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.619 ' HE1' HG22 ' A' ' 82' ' ' ILE . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 75.51 111.89 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 71.13 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.437 ' ND2' ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.34 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.54 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 75.44 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 73.12 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.41 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.619 HG22 ' HE1' ' A' ' 75' ' ' MET . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 74.45 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.34 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 73.43 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 63.42 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 74.11 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 74.33 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.22 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.12 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 74.45 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.34 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.13 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 74.52 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.32 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.52 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 75.21 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 73.44 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.11 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 74.34 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.694 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 . . . . . 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.02 110.134 175.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 112.119 0.414 . . . . 71.5 112.119 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 75.41 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.24 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.44 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.416 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 75.52 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.587 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 73.51 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 73.54 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.587 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 75.52 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 72.32 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 63.14 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.53 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.32 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.13 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.528 HG12 HG21 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.22 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.21 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 65.43 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 74.1 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 75.43 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 74.41 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 74.12 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.444 HG11 HD12 ' A' ' 87' ' ' ILE . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 74.24 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 73.43 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.44 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 74.3 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.32 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 62.23 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 74.14 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.42 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.31 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.541 ' HB3' ' HZ3' ' A' ' 41' ' ' LYS . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 75.22 111.57 171.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.528 HG21 HG12 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.45 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.427 ' HB2' HG13 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.32 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.11 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 72.21 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.707 HG13 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.54 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.03 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.3 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 74.23 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 74.34 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 73.41 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.15 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.1 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.01 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.12 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 73.34 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 55.13 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.406 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.14 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.42 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.12 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 75.34 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.41 ' O ' HG21 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 75.13 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 74.42 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.45 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.51 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.14 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.707 ' HB ' HG13 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.41 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.31 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.23 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.427 HG13 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 73.03 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 73.03 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 75.31 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.565 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 72.12 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.636 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 75.24 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.04 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 62.13 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.773 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.11 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.773 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 73.21 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 74.44 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.607 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 73.35 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 72.53 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.32 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.4 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.43 HD22 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.43 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.607 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 73.35 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.02 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 73.23 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.415 HG13 HG22 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.2 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 75.52 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 73.44 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.459 ' O ' HG21 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 74.12 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.427 ' HA ' HG21 ' A' ' 97' ' ' VAL . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.33 111.754 174.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.53 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.35 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 71.44 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 64.4 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 74.15 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 112.214 0.45 . . . . 74.43 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.3 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.14 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.403 HG11 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.24 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 73.22 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.666 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 73.52 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.02 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 63.54 112.18 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.666 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.02 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.42 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.424 HD13 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.1 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 72.12 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 75.45 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.31 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 74.02 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 75.24 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.31 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 55.03 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.45 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 75.34 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.43 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.505 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 64.22 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.31 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.13 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.52 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.15 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 75.43 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.34 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.708 ' HE1' HD13 ' A' ' 82' ' ' ILE . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.33 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 73.42 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 72.23 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.505 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.21 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 65.25 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 75.44 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 74.33 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.44 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 65.41 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.608 HG13 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.53 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.1 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 75.15 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 74.33 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.24 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.11 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.403 HG23 HG11 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 75.14 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.43 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 74.43 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 75.44 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.53 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 74.23 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.487 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.54 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.24 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 70.14 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.481 HG21 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.51 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.2 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 73.22 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 72.33 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.519 HD12 HG11 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 74.31 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.55 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 71.41 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.608 ' HB ' HG13 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 75.41 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 75.22 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 74.12 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 73.44 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 70.43 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 75.31 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.547 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 72.42 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.454 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 72.22 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.599 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 75.5 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.23 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 71.43 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.778 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.778 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.24 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 65.14 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.708 HD13 ' HE1' ' A' ' 36' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.2 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 75.55 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 73.34 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.44 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.45 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 73.25 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.54 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 74.11 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.43 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 73.24 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 71.15 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.449 ' O ' HG21 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 72.24 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.45 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.11 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 72.44 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.14 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.14 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 71.25 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 63.23 110.116 -174.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.408 HG21 ' SD ' ' A' ' 56' ' ' MET . 90.8 mt . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 120.351 0.119 . . . . 74.22 111.114 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.31 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.03 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.43 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.41 110.63 170.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 72.4 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.22 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.53 112.081 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.41 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.34 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 64.0 111.064 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.02 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 75.13 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 75.35 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 74.03 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 71.44 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.33 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.453 ' O ' HG22 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 73.41 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.647 HG22 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.42 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HB3' ' HZ3' ' A' ' 27' ' ' LYS . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.32 111.474 -175.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.44 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.545 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 74.1 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 72.52 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.63 ' HB3' ' HZ3' ' A' ' 31' ' ' LYS . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 74.44 111.35 164.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.11 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.13 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.2 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 74.4 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.573 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.32 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.411 ' HA ' HD21 ' A' ' 40' ' ' ASN . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.2 111.797 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.1 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.545 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.52 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' A' ' 37' ' ' GLU . 54.7 m-80 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.31 109.726 170.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.05 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 75.23 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.35 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.51 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.52 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.568 HG13 HD13 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 74.4 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 74.43 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 72.42 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.12 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.43 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.05 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.11 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.43 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 73.52 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.24 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.34 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.49 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 74.42 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.12 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.14 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.31 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' O ' HG21 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 75.04 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 73.43 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.568 HD13 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 72.4 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.23 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.427 HG21 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.22 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG12 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 74.13 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.05 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 60.5 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 73.13 110.783 -175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.15 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 70.13 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.565 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.52 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.459 ' HE2' HG22 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 75.03 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.524 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 75.52 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 74.54 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 73.32 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.756 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 71.22 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.756 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.13 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 75.01 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.459 HG22 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 75.03 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.488 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.3 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 73.41 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.488 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 74.4 109.651 172.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 74.34 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 74.13 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 74.31 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' HG22 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 63.35 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 74.02 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.11 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.4 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.51 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 75.54 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.13 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 74.01 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.12 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 73.12 111.398 -179.314 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.721 -0.103 . . . . 63.33 110.721 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 75.15 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 73.4 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 71.13 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 73.11 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.34 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.13 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 71.12 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.44 111.341 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.4 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.417 HD22 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 72.23 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.561 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.53 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 73.23 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.22 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 74.01 111.303 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 73.1 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.519 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.43 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.49 ' O ' HG21 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 70.24 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.518 HG22 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 74.13 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.44 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 74.32 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.517 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 74.33 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.35 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 75.24 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.31 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.43 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.1 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 74.35 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.409 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.4 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 60.35 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.517 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 75.11 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.44 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.477 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 74.3 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.34 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 75.02 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.34 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 65.21 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.514 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 70.24 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.34 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.417 ' HB ' HD22 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.41 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 62.45 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 75.4 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.23 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.13 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 65.02 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.02 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 74.21 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.43 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 53.43 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.443 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.42 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 71.32 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 64.21 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.421 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.51 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.12 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 75.1 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 75.32 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.514 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.43 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.41 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 75.24 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HB ' HG12 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.23 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 75.12 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.42 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.33 111.192 -176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 54.02 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.04 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.438 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 75.22 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.2 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.409 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.21 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 74.22 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.13 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 75.14 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.438 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.34 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.44 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.527 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 72.03 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.464 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 72.2 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 64.34 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.14 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 71.24 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.42 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.44 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 72.21 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.55 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 72.32 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 74.41 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' HG21 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 75.02 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.561 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.45 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.3 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 74.51 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 71.42 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 74.21 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.42 110.404 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.115 0.483 . . . . 73.44 111.495 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.442 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.23 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 64.52 110.854 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 70.32 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 74.13 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 71.43 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.32 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 75.22 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 74.32 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.24 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 73.21 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 72.04 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.13 111.94 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.55 HG13 HG21 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 70.5 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.13 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.23 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.48 ' O ' HG21 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.23 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 72.12 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.41 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.44 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 65.21 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 73.33 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 70.01 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.34 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 65.04 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 74.01 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.01 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.727 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 73.31 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 71.54 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.44 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.549 ' HB3' HG11 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 51.6 t30 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.12 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.45 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.55 HG21 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 73.12 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.33 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.2 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 75.53 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.574 HG11 HD13 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 74.22 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 74.41 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 64.32 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.1 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 71.52 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 73.3 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.13 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.521 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.31 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.21 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 75.31 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 74.52 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.14 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.521 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.34 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 74.42 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.44 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 74.33 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 64.31 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.426 ' O ' HG21 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 72.22 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 74.05 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.574 HD13 HG11 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 73.12 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.22 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.426 HG21 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 73.01 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.478 ' HB ' HG13 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.42 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 71.52 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.628 HD21 HD22 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.3 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.549 HG11 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.35 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 75.14 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 72.5 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.402 ' HB3' HG13 ' A' ' 82' ' ' ILE . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 73.41 112.083 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.727 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 75.42 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.436 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.33 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.34 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.692 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.41 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.717 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 74.11 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.51 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.412 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 74.52 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.01 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.423 ' HA ' HD13 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.45 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 71.25 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.628 HD22 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 72.44 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.51 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.663 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 72.1 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 71.04 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.15 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.663 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 70.41 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 74.14 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 75.5 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 71.11 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 73.5 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.22 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.41 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 75.31 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 74.43 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 . . . . . 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.34 111.265 173.919 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.442 HG21 ' HE3' ' A' ' 56' ' ' MET . 32.2 mm . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.187 0.44 . . . . 73.24 112.187 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.35 111.578 173.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.31 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 72.15 112.158 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.43 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.22 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 70.34 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.01 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.22 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.54 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.41 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.54 111.57 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.22 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 75.34 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.42 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.53 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.498 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.41 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.474 ' O ' HG21 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.43 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.45 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.44 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.24 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.53 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 73.32 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 72.43 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.51 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.11 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.42 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.44 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.535 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 74.51 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.54 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.53 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 74.43 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 70.34 110.041 173.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 74.43 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.415 HG21 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 73.32 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.43 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 73.13 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.15 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 71.13 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 75.42 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.54 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.42 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 75.5 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.55 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 64.25 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.44 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 73.41 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.41 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.14 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.442 ' HE3' HG21 ' A' ' 8' ' ' ILE . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 73.11 111.991 172.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.44 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.02 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 70.14 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 70.43 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 63.1 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 54.55 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.24 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.41 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 74.42 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.44 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 70.11 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.496 HD13 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 73.43 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 74.51 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 74.22 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.42 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 74.24 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.13 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.661 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 74.44 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.521 ' HE3' HG22 ' A' ' 82' ' ' ILE . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 72.2 111.871 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.21 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.2 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 74.33 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.727 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.3 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.727 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.1 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.52 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.53 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 73.12 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.561 ' HA ' HD11 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 63.24 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.34 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.506 HD13 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.23 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.23 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.632 ' HA ' ' HZ1' ' A' ' 91' ' ' LYS . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 74.32 110.819 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.506 ' HD2' HD13 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 74.02 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 72.33 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.632 ' HZ1' ' HA ' ' A' ' 88' ' ' ASP . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.05 111.794 173.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.488 ' HB2' ' HZ2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 75.34 112.699 -176.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.496 ' HB3' HD13 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 71.05 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 53.02 110.651 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.13 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 73.43 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.54 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 75.34 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.468 ' O ' ' HD3' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.45 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 75.32 109.729 174.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm . . . . . 0 CA--C 1.559 1.294 0 CA-C-O 120.972 0.415 . . . . 74.31 111.581 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.11 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 75.04 111.158 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.02 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 74.44 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.32 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 70.11 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 73.31 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.23 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 64.45 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 62.34 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.31 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 74.04 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.42 111.85 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.421 HG13 HG21 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.52 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.24 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.31 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 72.25 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 63.25 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 75.1 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.42 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.513 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.45 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.11 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 74.01 111.538 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.33 110.588 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 75.21 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.4 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.724 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.24 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.22 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.45 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.513 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.15 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.01 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.689 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.1 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.421 HG21 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.42 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.23 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.689 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 75.0 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 74.41 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.578 HG13 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.02 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.31 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.429 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 74.54 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 75.51 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 72.52 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.01 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.44 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.473 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 72.23 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.03 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 55.44 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.31 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.32 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.473 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.43 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.35 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.41 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.14 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 64.34 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HZ1' ' HB3' ' A' ' 63' ' ' LYS . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.51 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 71.41 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.13 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 73.55 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.582 HD13 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 72.22 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.32 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.34 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 73.41 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.33 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.44 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.42 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.579 ' HE3' HG21 ' A' ' 82' ' ' ILE . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 74.2 112.519 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.724 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.15 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 72.24 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.42 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 75.0 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 73.21 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.23 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.579 HG21 ' HE3' ' A' ' 75' ' ' MET . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.03 108.767 177.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.414 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.14 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 64.34 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.23 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.33 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.14 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.53 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.44 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.428 HG13 HG22 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 74.54 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.425 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 75.43 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 74.4 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.582 ' HB3' HD13 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 74.24 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.444 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 72.23 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 74.04 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.31 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.15 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 75.02 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.33 110.212 -177.286 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.496 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm . . . . . 0 CA--C 1.557 1.234 0 CA-C-O 120.968 0.413 . . . . 74.42 110.797 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 72.4 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.35 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.23 111.794 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 71.45 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.32 113.413 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.33 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.33 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.44 111.456 -173.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.12 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.11 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.13 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.21 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.32 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.53 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.43 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.43 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.54 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.438 ' O ' HG21 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.22 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.448 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.23 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 73.52 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.41 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.545 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 65.43 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.35 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 74.41 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.52 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 72.14 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.46 ' HA ' HD12 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.31 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 71.34 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.596 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.04 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.01 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 72.45 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.545 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.43 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 72.2 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 75.22 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.31 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.51 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 74.35 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.12 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.635 HG12 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.42 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 74.03 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.31 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.15 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 71.35 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.54 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.1 110.363 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.53 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.44 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.496 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 73.5 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.42 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.487 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.53 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 74.11 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.43 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.436 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 72.21 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.32 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.441 ' O ' HG21 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 75.15 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 74.5 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.415 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 53.3 t-80 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 71.43 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.42 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.2 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.415 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 74.2 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.41 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.11 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 74.31 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.13 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.468 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 75.34 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.432 ' HB3' ' HE2' ' A' ' 36' ' ' MET . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 73.13 111.343 174.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.576 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.32 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 55.42 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.53 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.684 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.24 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.684 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.54 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 75.32 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.495 HG23 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 75.45 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.423 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 72.32 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.495 ' H ' HG23 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 74.52 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.44 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.423 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.13 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 73.0 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 72.24 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 72.41 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.02 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.448 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.23 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.53 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 74.21 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 75.31 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.402 ' O ' ' HG3' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.14 109.279 170.261 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 71.51 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 74.01 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 74.21 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 95' ' ' ASP . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.33 111.821 -178.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.41 110.549 178.918 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 120.657 0.265 . . . . 72.23 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.51 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 75.42 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.4 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.51 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.537 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.52 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.22 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.52 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.537 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 75.15 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 71.22 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 75.31 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.42 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.44 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.21 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.13 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 73.25 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.487 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 71.4 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.473 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.43 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 72.24 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.14 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.512 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 64.44 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.14 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HZ1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 71.35 111.509 174.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 71.5 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.32 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.44 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 75.13 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.54 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.512 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.24 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.23 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 71.33 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 73.33 111.111 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 75.53 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.01 112.271 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 75.31 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD13 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 73.43 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.401 ' HD2' ' HE3' ' A' ' 69' ' ' MET . 46.6 t-80 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.11 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 74.0 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 74.43 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.3 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.52 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 63.03 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.507 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 72.22 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.1 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.31 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 75.44 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.507 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.33 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.33 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 70.02 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.24 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.04 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.484 ' O ' HG21 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.32 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.565 HD13 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.55 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.14 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.484 HG21 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 74.34 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 75.43 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.401 ' HE3' ' HD2' ' A' ' 47' ' ' HIS . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.25 110.402 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.12 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 74.43 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 75.1 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 75.12 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.23 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.438 ' HB3' ' HE1' ' A' ' 36' ' ' MET . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 74.33 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 74.44 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.499 HD21 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.43 111.701 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.53 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.52 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.34 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.52 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 75.35 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 73.3 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.21 109.821 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 75.31 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.421 ' HA ' HD13 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.52 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 74.4 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.51 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.35 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.05 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 74.24 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.417 ' HG2' HG22 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.11 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.33 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.42 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 75.34 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.23 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 72.1 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.51 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 74.05 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.51 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 75.34 109.568 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 112.463 0.542 . . . . 73.12 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.3 111.394 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 73.32 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 74.22 112.87 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 70.22 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 72.3 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.21 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD23 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.41 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.14 111.196 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.22 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.454 HD22 ' HB ' ' A' ' 48' ' ' THR . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.13 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.53 HG23 HD11 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 74.24 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.34 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.23 112.075 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 63.41 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.41 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 61.43 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 75.03 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.573 HG22 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.05 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.4 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 75.45 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.444 HG13 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.52 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.1 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 74.05 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.4 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.11 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 71.41 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.02 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.52 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.51 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 74.14 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.444 ' CE2' HG13 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.43 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.01 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 73.41 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 74.35 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 75.43 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 75.12 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.31 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.41 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 71.4 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.41 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.14 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 73.23 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 73.34 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 72.32 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.34 112.655 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.42 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.43 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.13 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 65.22 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.04 111.096 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.23 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.34 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 74.12 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 60.05 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 75.13 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.14 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.4 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 74.02 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.553 ' HB ' HG12 ' A' ' 46' ' ' VAL . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 72.45 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 71.33 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 72.23 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 72.13 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.41 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 65.32 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.41 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.537 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 74.12 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 73.31 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 71.31 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.4 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.445 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.31 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.445 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.14 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.533 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.44 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.533 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.45 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.626 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 71.33 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.13 113.265 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 71.12 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.626 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.53 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.03 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.42 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 73.3 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.416 HG12 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.12 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 74.42 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.728 ' HZ1' ' HB2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 61.23 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 74.04 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.53 HD11 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 72.11 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 72.43 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.477 HG12 HD23 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.43 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.53 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 64.12 112.39 -173.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.72 0.295 . . . . 75.12 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 71.22 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.42 112.569 -178.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.35 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 74.53 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.559 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 73.12 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.2 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.21 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.45 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.41 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.454 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 73.31 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.439 ' HA ' HD22 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.45 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 71.25 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 75.31 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 74.31 111.924 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 75.54 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.22 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.539 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.4 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.41 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.33 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 74.15 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 74.31 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.04 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.01 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 75.45 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.21 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.32 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.57 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.54 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 70.1 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.33 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.447 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.35 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 75.54 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.43 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 74.22 112.024 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.1 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 73.22 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 75.32 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.567 HG13 HD11 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 75.34 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 71.12 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.21 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.15 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HE3' ' HD2' ' A' ' 66' ' ' HIS . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 74.1 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 75.02 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 74.31 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.51 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 74.22 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 72.15 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.03 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.43 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 71.45 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.51 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.14 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.52 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.23 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 74.45 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.31 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.45 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 75.23 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.567 HD11 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.44 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.437 ' HD2' ' HE3' ' A' ' 50' ' ' LYS . 57.5 t-80 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 75.15 110.952 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 73.22 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.452 ' HB ' HG12 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.43 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 75.54 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.33 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.34 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 74.14 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.03 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.22 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 72.23 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.57 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.22 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.468 HD21 ' HG2' ' A' ' 79' ' ' GLU . 0.4 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.31 112.233 -178.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 64.34 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.718 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 73.12 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.718 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 74.24 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 72.41 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 64.55 109.432 -174.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.52 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 74.54 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.31 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.447 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 73.14 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.41 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 71.2 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.42 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 74.33 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.31 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.418 ' O ' HG21 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 74.43 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.13 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.23 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.42 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.11 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 74.21 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.44 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 73.24 110.917 178.518 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.556 1.178 0 N-CA-C 111.639 0.237 . . . . 73.41 111.639 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 71.53 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 74.11 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.466 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 73.2 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.22 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.43 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 72.4 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.597 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 73.12 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.597 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 75.44 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.12 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 73.13 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.12 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 71.4 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 72.04 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.432 HG13 HG21 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.43 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.12 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.23 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.488 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 74.4 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.578 HG22 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.44 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 73.51 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.32 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.595 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 71.44 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.32 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 73.32 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.4 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 75.22 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.41 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.463 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.54 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.55 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.43 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.595 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.52 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.45 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.41 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.488 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 73.41 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.42 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 72.23 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.33 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.541 HG13 HD13 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 71.34 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 74.05 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.34 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 74.13 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.54 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 75.33 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 75.22 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 72.21 111.885 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.53 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.42 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.31 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.24 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 73.13 111.46 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.44 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.1 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.31 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 52.52 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 71.21 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.53 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.541 HD13 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.14 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.33 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 73.15 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.46 HG21 HG22 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 72.33 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 71.12 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.34 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 73.45 110.762 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.491 HG11 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.35 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 72.11 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.678 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 74.41 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.674 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 75.11 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.24 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 60.32 110.699 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 75.41 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.634 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 71.42 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.4 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 75.35 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.674 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.21 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.3 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.24 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.52 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 74.22 111.454 175.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 75.51 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.53 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.44 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.436 HG12 HG22 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.12 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.578 ' HG2' HG22 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 74.11 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.11 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.412 ' O ' HG21 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.53 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 75.24 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 75.14 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.461 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.01 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 74.24 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.45 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.24 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 . . . . . 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 61.53 111.702 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.54 HG22 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.933 0.397 . . . . 65.24 111.052 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 64.44 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 75.14 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.566 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.22 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.42 111.189 165.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.32 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 75.24 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.516 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 75.05 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.516 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.24 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.34 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.33 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.437 HG22 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.1 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 70.14 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 73.23 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.21 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 71.21 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.55 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.2 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.01 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.05 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.23 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.54 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 72.33 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.51 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 72.21 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 72.44 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.33 112.443 -173.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.11 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.54 ' HA ' ' HE2' ' A' ' 36' ' ' MET . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.02 111.984 -173.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.44 ' HA ' HD21 ' A' ' 40' ' ' ASN . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 73.22 111.377 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 75.52 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.33 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.44 HD21 ' HA ' ' A' ' 37' ' ' GLU . 58.1 m-80 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.21 110.222 170.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HZ2' ' HG2' ' A' ' 37' ' ' GLU . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.24 111.132 174.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.412 HG21 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 75.31 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.13 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.45 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.44 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.618 HG12 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.53 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 73.11 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.42 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 73.34 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 74.32 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.4 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.409 ' O ' HG21 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.51 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 54.31 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 74.3 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.409 HG21 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 74.22 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.54 ' SD ' HG22 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 71.41 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 71.25 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.22 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 75.35 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.23 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.6 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 71.21 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.02 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.45 ' O ' HG21 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.32 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 73.21 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.599 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 73.35 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 75.13 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.45 HG21 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.02 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.618 ' HB ' HG12 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 74.31 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.498 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.55 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.34 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 65.21 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 75.32 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 73.43 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 71.33 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.458 ' HB3' HD12 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 74.23 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 74.03 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 72.42 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.23 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.31 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 65.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.458 HD12 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 73.33 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.2 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 74.3 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.469 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 74.51 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.45 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.2 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 74.23 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 75.15 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 73.21 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 73.42 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.403 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.45 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' HG21 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.33 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.437 ' HG ' HG22 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.23 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.03 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.51 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.14 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.21 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.403 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.54 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.24 110.874 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.052 0.453 . . . . 64.04 110.933 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 74.02 111.328 171.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 63.35 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 73.32 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 72.44 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.33 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.02 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.421 HD23 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.11 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 75.42 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.52 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.487 HD22 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 73.05 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.52 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.11 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.21 111.999 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.572 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.03 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.12 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.721 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.43 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.41 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.449 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.14 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.721 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.53 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.53 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.541 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.2 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 64.12 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 72.32 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.14 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 75.31 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 75.34 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.52 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.585 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.45 113.467 -170.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.479 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 70.14 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.14 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.541 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 74.51 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.479 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 72.11 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HB3' ' A' ' 41' ' ' LYS . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.53 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.572 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.43 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.04 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.3 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 73.11 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.02 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.22 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD22 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.42 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.12 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.42 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 74.14 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 74.5 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.417 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.31 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.44 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 74.15 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 74.22 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.11 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.43 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.11 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.52 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.417 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 71.42 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 63.24 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.422 ' O ' HG21 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.51 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.42 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 73.21 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 75.45 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 63.22 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.428 HD13 ' H ' ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.45 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.402 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 75.25 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 61.24 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.32 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 74.21 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.04 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.602 ' HE2' HG22 ' A' ' 82' ' ' ILE . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 65.54 111.747 174.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 73.42 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 61.01 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 75.51 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.593 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 75.31 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.593 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 75.31 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 73.52 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.602 HG22 ' HE2' ' A' ' 75' ' ' MET . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 74.34 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.13 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' HD13 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 54.22 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.23 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.33 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 HG11 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.24 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.42 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.03 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.33 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.449 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.41 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 75.23 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.34 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.42 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 71.14 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.421 HG12 HD23 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.41 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 74.52 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.13 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.32 111.229 176.41 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.003 -0.046 . . . . 75.45 111.013 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.42 111.557 176.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.574 ' HB3' ' HZ2' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.34 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 54.33 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.23 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 71.33 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.33 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.43 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 74.31 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 75.3 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.2 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.31 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.412 ' HA ' HD13 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 72.11 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 75.23 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.43 112.088 178.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.32 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.51 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.446 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 64.32 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.53 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.01 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.32 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 74.51 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.475 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.12 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.22 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 74.43 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 73.42 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.44 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.02 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.01 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.486 ' HE3' ' HB3' ' A' ' 75' ' ' MET . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.2 112.514 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.42 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.14 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.475 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.34 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.04 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 73.43 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 73.33 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 72.25 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 70.3 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.13 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.483 HG12 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.24 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 64.04 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.448 ' HB ' HD22 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.33 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.51 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.15 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 73.14 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 74.13 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.429 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 73.54 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 72.5 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.55 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.461 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.11 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 75.51 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.429 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.1 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.52 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.04 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.5 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 74.45 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG21 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 75.31 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 72.22 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 75.11 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.13 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.466 HG21 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.12 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.483 ' HB ' HG12 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.1 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.24 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.05 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.44 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.23 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.54 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 62.54 112.321 172.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.486 ' HB3' ' HE3' ' A' ' 36' ' ' MET . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.32 111.905 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.35 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.542 HD21 ' HB2' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.3 111.692 -179.342 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 75.44 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.542 ' HB2' HD21 ' A' ' 77' ' ' ASN . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.31 111.265 172.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 72.03 110.644 -169.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 73.01 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.53 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.42 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.1 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.34 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.12 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 74.4 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.44 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.451 HG13 HG22 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 74.42 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 74.42 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 74.55 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.24 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 73.43 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 74.45 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' MET . . . . . 0.423 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 74.32 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.15 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 73.11 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 75.23 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 . . . . . 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.688 0.28 . . . . 74.24 111.037 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 75.24 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 75.12 111.706 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.41 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 74.12 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.14 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.23 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 75.33 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.2 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.4 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.521 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.51 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 75.05 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 74.21 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 62.14 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.46 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.4 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.42 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.607 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.42 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.43 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.6 HG22 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 63.32 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.607 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 74.54 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.44 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.552 HG13 HD12 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.45 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 72.5 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.2 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.33 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 74.12 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.519 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 71.32 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.52 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.41 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 75.12 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.44 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.32 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.34 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.472 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 65.25 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.41 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.421 ' HB2' HG13 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 74.12 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.12 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 64.33 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.589 HG13 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 73.42 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.449 ' HD2' ' HE2' ' A' ' 69' ' ' MET . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.3 110.5 171.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.13 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 73.24 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.53 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 75.52 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.4 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.2 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 73.32 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.35 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.426 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 73.25 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.42 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 74.13 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 73.41 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 73.21 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.422 ' O ' HG21 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 64.33 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 72.12 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.4 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.52 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.24 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.589 ' HB ' HG13 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.13 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.449 ' HE2' ' HD2' ' A' ' 47' ' ' HIS . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 72.21 110.866 172.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.24 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.408 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 74.13 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.421 HG13 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.12 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.43 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 74.5 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.539 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.13 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.47 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 71.41 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.42 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.44 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.53 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.04 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.53 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 71.41 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 74.33 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.539 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 73.15 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.41 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.5 ' HA ' HD13 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.14 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.44 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.534 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.33 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.552 HD12 HG13 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 73.31 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.22 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.54 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 74.43 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG2' HG22 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.44 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 73.21 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.501 ' O ' HG22 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 73.35 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.426 HD21 HG11 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.45 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.34 111.73 170.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 73.22 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.1 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 74.54 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 75.31 112.835 -175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 64.35 111.352 175.08 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.778 0.323 . . . . 75.22 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 74.23 111.139 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.33 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 73.12 111.679 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.49 HG23 ' HZ2' ' A' ' 16' ' ' LYS . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.3 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.656 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 64.43 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.31 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 72.4 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.656 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 74.0 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 61.21 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.442 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 75.23 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 73.05 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.13 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.45 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.459 HG13 HG21 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 75.15 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.34 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.45 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.13 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.13 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.567 ' HB3' ' HZ3' ' A' ' 27' ' ' LYS . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 75.22 111.684 173.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.11 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.505 HG13 HD12 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.31 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.43 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 71.03 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.23 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.24 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 71.2 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 74.22 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.558 ' HE1' ' HB3' ' A' ' 75' ' ' MET . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 72.53 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 73.33 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 75.1 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.468 ' HB3' HG11 ' A' ' 72' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.44 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.23 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.42 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.459 HG21 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 75.31 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.15 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 75.54 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 74.11 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.15 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.11 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.442 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.12 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.415 ' HB2' HD12 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 72.14 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 74.12 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 75.14 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 74.33 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.506 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 71.14 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 64.42 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.44 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 75.4 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.15 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.506 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.43 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.14 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.43 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.442 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.43 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 70.15 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.34 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 72.31 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 49' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 75.43 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.22 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.31 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 71.33 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 64.11 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.51 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.44 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 72.45 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 61.24 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 74.43 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.558 ' HB3' ' HE1' ' A' ' 36' ' ' MET . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.44 112.472 177.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 73.23 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.04 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.31 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.15 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 71.44 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 73.51 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 75.31 110.135 -170.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.412 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.44 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 64.32 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.11 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 75.24 110.965 172.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.505 HD12 HG13 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.13 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.52 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 74.43 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 73.4 110.438 177.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.468 ' HZ3' ' HB2' ' A' ' 91' ' ' LYS . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 73.31 111.725 171.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 73.32 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG21 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 73.44 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.35 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.44 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.11 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.21 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 74.32 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.22 113.533 -176.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.42 110.185 176.333 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 112.014 0.375 . . . . 74.22 112.014 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 74.22 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.31 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.33 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.33 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.4 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.45 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 65.0 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.52 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.14 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.11 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.04 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.34 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.448 HG13 HG21 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 75.04 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 70.15 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.655 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 74.15 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.458 ' O ' HG21 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 74.41 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 74.22 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.655 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 74.33 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.1 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.52 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 74.34 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.22 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 73.21 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 62.15 110.352 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 70.32 114.723 -171.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.35 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 72.34 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.651 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.23 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 72.11 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.43 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.52 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 74.04 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.35 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.51 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.448 HG21 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 74.11 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 74.35 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 74.11 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.606 HG12 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.33 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 73.4 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 73.03 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 74.54 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 74.05 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.35 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 73.33 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.4 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.34 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 74.21 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 72.34 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.54 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.13 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.42 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 71.21 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.413 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 64.12 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.04 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 73.13 111.992 175.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 55.15 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.23 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.45 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 64.31 110.511 175.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.606 ' HB ' HG12 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.32 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 74.23 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 62.52 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 75.3 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 73.42 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.53 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 74.22 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 72.25 112.152 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.651 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 71.23 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.23 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.41 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.652 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 75.13 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.652 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 64.13 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.31 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 74.53 109.52 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 72.32 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.506 ' HA ' HD13 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 62.23 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.45 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.624 HD11 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 75.21 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.506 HD13 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 74.14 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 72.22 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 75.2 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.22 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.04 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 75.43 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 75.3 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 74.11 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.473 ' N ' HD11 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.13 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 71.13 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.12 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.11 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.41 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 72.14 110.633 176.001 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 111.863 0.32 . . . . 75.41 111.863 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 73.41 111.885 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 74.41 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 72.41 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.52 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.599 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 63.3 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.41 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 74.12 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 73.12 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.32 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.52 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.22 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 75.44 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.12 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.02 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 74.03 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.22 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.436 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.15 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.41 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 71.52 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 74.22 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.504 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 75.31 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.42 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 72.15 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.401 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 63.1 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.14 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 74.43 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 75.24 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.564 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.34 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 73.54 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.401 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.42 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.13 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.42 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.44 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.521 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 75.33 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.43 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.41 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 73.43 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 75.21 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.22 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.42 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.23 110.601 173.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 75.51 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 63.0 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 74.41 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.23 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.32 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 74.01 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.15 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 55.15 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.478 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.21 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.33 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.33 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 75.43 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 72.11 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.22 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 65.44 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.47 ' HA ' HD12 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.24 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.12 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.14 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.562 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.4 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 75.23 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 72.0 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.43 HD22 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 74.34 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 74.34 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 72.23 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.24 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 73.23 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.564 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.11 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 60.12 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 74.12 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.705 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 72.23 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.705 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.21 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.15 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.445 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 74.23 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.13 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.11 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.41 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.415 HD11 HG13 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 74.13 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.22 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.457 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.33 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.41 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 74.44 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.4 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.562 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 64.04 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 74.24 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 73.0 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.31 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 73.14 110.475 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.42 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.03 109.798 171.729 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.458 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.554 0.216 . . . . 74.02 110.915 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.49 64.5 4.29 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 116.515 -0.311 . . . . 62.03 112.804 177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.3 p -151.99 150.09 29.61 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.719 0.808 . . . . 74.34 111.208 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 -83.26 106.72 15.27 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.099 0.56 . . . . 72.42 110.69 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -64.73 -30.6 71.62 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.642 0.777 . . . . 75.34 111.258 177.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -55.9 -34.76 65.85 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.949 0.9 . . . . 64.33 112.153 175.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -64.95 -50.65 65.58 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.919 0.488 . . . . 74.5 110.575 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -58.24 -41.18 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.779 0.831 . . . . 75.11 111.442 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 74.53 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.542 ' HZ1' ' HB3' ' A' ' 10' ' ' LYS . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 75.05 111.388 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 74.0 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.427 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.21 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.3 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.1 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.427 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.21 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.14 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.431 ' HA ' HD12 ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 73.01 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD13 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 71.31 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 73.15 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.43 111.702 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.467 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.52 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.442 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 71.22 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 70.14 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.34 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.425 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 73.52 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.41 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.34 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.537 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 74.35 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 75.11 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.15 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 73.54 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.41 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.468 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.34 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.52 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.02 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 71.33 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.33 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.537 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.44 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 71.4 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.42 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.11 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 63.41 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 74.31 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.23 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.665 HG13 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.12 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.41 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 72.03 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 75.52 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.4 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 74.22 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.24 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 74.45 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 74.23 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 64.31 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.11 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.404 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 73.43 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 74.15 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 74.4 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.694 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 73.35 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.44 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.458 ' O ' HG21 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 74.45 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.58 HD13 HG11 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 72.45 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.43 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 75.4 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.665 ' HB ' HG13 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.13 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 72.21 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 74.42 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 72.05 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.32 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 64.3 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.42 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.619 ' HE1' HG22 ' A' ' 82' ' ' ILE . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 75.51 111.89 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 71.13 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.437 ' ND2' ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.34 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.54 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 75.44 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 73.12 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.41 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.619 HG22 ' HE1' ' A' ' 75' ' ' MET . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 74.45 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.34 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 73.43 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 63.42 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 74.11 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.419 HD12 HG11 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 74.33 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.22 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.12 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 74.45 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.34 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.13 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 74.52 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.32 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.52 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 75.21 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 73.44 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.11 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 74.34 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.694 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 -77.86 -34.41 51.76 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.02 110.134 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.0 tt -65.85 -27.2 68.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.941 0.896 . . . . 74.32 110.957 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -32.1 69.88 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.847 -0.533 . . . . 72.14 111.589 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -76.41 -15.91 59.83 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.313 0.645 . . . . 72.44 112.507 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -57.64 -32.99 67.81 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.184 0.994 . . . . 72.21 113.541 -172.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.7 m -69.79 -33.14 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.429 0.529 . . . . 74.13 112.429 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -79.46 -65.49 0.99 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.105 0.562 . . . . 65.21 110.767 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.82 -2.03 84.55 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 114.336 0.494 . . . . 72.45 114.336 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 57.0 p -82.14 81.33 8.1 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.28 0.632 . . . . 73.25 110.679 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -84.14 69.47 10.39 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.38 0.672 . . . . 62.43 111.477 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.2 mt 71.93 -33.01 0.26 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.111 1.764 . . . . 74.21 114.947 175.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -63.66 137.83 97.2 Favored Pre-proline 0 CA--C 1.566 1.595 0 CA-C-N 118.652 0.66 . . . . 70.14 111.581 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_exo -54.31 -36.53 87.14 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 123.524 2.816 . . . . 71.21 114.503 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.559 1.305 0 C-N-CA 123.471 0.709 . . . . 73.21 109.251 -176.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 120.641 0.258 . . . . 70.14 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.1 104.94 2.88 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 111.72 -0.552 . . . . 74.44 111.72 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -67.3 110.36 3.5 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.655 0.782 . . . . 74.11 112.056 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -73.57 108.44 6.42 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.016 0.526 . . . . 53.51 111.046 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -61.23 -28.6 69.28 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.525 1.13 . . . . 73.23 112.113 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -59.11 -46.8 87.39 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.016 0.926 . . . . 74.4 110.757 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.52 -47.32 79.27 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 116.103 -0.499 . . . . 74.34 110.926 175.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm -58.35 -46.68 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.654 0.781 . . . . 71.5 112.119 -174.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 75.41 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.24 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.44 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.416 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 75.52 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.587 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 73.51 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 73.54 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.587 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 75.52 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 72.32 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 63.14 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.53 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.32 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.13 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.528 HG12 HG21 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.22 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.455 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.21 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 65.43 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 74.1 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 75.43 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 74.41 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 74.12 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.444 HG11 HD12 ' A' ' 87' ' ' ILE . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 74.24 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 73.43 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.44 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 74.3 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.32 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 62.23 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.636 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 74.14 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.42 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.31 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.541 ' HB3' ' HZ3' ' A' ' 41' ' ' LYS . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 75.22 111.57 171.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.528 HG21 HG12 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.45 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.427 ' HB2' HG13 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.32 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.11 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 72.21 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.707 HG13 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.54 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.03 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.3 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 74.23 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 74.34 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 73.41 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.15 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.1 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.01 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.12 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 73.34 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 55.13 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.406 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.14 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.42 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.12 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 75.34 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.41 ' O ' HG21 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 75.13 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 74.42 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.45 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.51 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.14 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.707 ' HB ' HG13 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.41 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.31 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.23 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.427 HG13 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 73.03 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 73.03 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 75.31 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.565 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 72.12 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.636 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 75.24 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.04 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 62.13 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.773 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.11 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.773 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 73.21 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.607 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 74.44 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.607 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 73.35 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 72.53 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.32 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.4 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.43 HD22 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.43 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.607 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 73.35 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.02 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 73.23 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.415 HG13 HG22 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.2 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 75.52 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 73.44 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.459 ' O ' HG21 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 74.12 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.427 ' HA ' HG21 ' A' ' 97' ' ' VAL . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.33 111.754 174.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.53 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.35 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.459 HG21 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 71.44 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 64.4 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 74.15 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -76.27 -29.06 57.3 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.507 ' HA ' ' HB2' ' A' ' 104' ' ' LYS . 95.3 mt -71.97 -29.9 64.73 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.018 0.927 . . . . 74.54 111.7 174.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -57.42 -48.35 79.36 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.494 0.718 . . . . 74.3 110.226 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -63.78 -40.97 97.95 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.804 -1.089 . . . . 71.14 110.811 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HB2' ' HA ' ' A' ' 101' ' ' LEU . 25.9 mmtt -57.31 -36.0 70.54 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.442 1.097 . . . . 75.33 112.667 177.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 101' ' ' LEU . 65.4 t -73.25 -50.92 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 122.38 0.272 . . . . 74.44 110.827 175.072 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 58.0 m 67.04 118.73 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.979 1.312 . . . . 74.21 111.503 -172.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.03 39.12 8.15 Favored Glycine 0 N--CA 1.478 1.471 0 CA-C-N 116.436 -0.347 . . . . 71.35 112.588 -174.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.3 m -96.81 22.5 8.15 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.905 0.882 . . . . 75.33 111.676 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -59.58 108.4 0.72 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.337 1.055 . . . . 73.41 112.017 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.68 99.33 2.09 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.967 0.507 . . . . 75.42 110.563 178.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.1 m -70.5 143.95 90.93 Favored Pre-proline 0 CA--C 1.569 1.699 0 C-N-CA 123.436 0.694 . . . . 75.43 111.381 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.24 113.31 2.0 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.755 2.303 . . . . 71.31 113.406 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 CA--C 1.564 1.5 0 C-N-CA 123.771 0.828 . . . . 74.31 111.562 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 110.411 -0.218 . . . . 74.42 110.411 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.02 116.78 6.09 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-O 120.191 -0.227 . . . . 73.25 112.676 175.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.5 p -61.64 -31.01 71.09 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.718 0.807 . . . . 61.41 112.451 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -77.94 110.59 12.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.184 0.593 . . . . 73.54 109.984 174.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -64.45 -30.46 71.49 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.687 0.756 . . . . 73.14 109.987 170.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -50.32 -45.57 54.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 125.242 1.417 . . . . 60.03 111.985 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -71.07 -47.45 58.27 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.257 1.023 . . . . 63.11 111.357 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm -58.19 -40.39 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.819 0.848 . . . . 74.43 112.214 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.3 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.457 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.14 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.403 HG11 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.24 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 73.22 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.666 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 73.52 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.02 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.422 HD22 ' HG ' ' A' ' 101' ' ' LEU . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 63.54 112.18 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.666 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.02 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.42 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.424 HD13 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.1 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 72.12 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 75.45 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.31 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 74.02 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.494 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 75.24 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.31 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 55.03 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.45 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 75.34 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.43 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.505 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 64.22 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.31 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.13 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.52 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.15 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 75.43 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.34 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.708 ' HE1' HD13 ' A' ' 82' ' ' ILE . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.33 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 73.42 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 72.23 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.505 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.21 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 65.25 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 75.44 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 74.33 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.44 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 65.41 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.608 HG13 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.53 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.1 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 75.15 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 74.33 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.24 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.11 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.403 HG23 HG11 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 75.14 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.43 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 74.43 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 75.44 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.53 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 74.23 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.487 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.54 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.24 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 70.14 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.481 HG21 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.51 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.2 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 73.22 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 72.33 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.519 HD12 HG11 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 74.31 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.55 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 71.41 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.608 ' HB ' HG13 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 75.41 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 75.22 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 74.12 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 73.44 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 70.43 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 75.31 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.547 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 72.42 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.454 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 72.22 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.599 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 75.5 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.23 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 71.43 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.778 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.778 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.24 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 65.14 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.708 HD13 ' HE1' ' A' ' 36' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.2 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 75.55 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 73.34 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.44 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.45 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 73.25 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.54 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 74.11 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.43 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 73.24 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 71.15 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.449 ' O ' HG21 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 72.24 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.45 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.11 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 72.44 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.449 HG21 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.14 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.14 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 71.25 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.444 ' O ' ' HD2' ' A' ' 104' ' ' LYS . 0.7 OUTLIER -74.3 -37.73 63.55 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 63.23 110.116 -174.265 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.422 ' HG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tm? -58.47 -50.74 72.63 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.305 0.642 . . . . 73.31 109.782 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.58 -28.94 66.02 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.031 0.932 . . . . 64.24 111.558 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -73.49 -28.38 61.89 Favored 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 123.78 0.832 . . . . 71.31 111.964 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 100' ' ' GLU . 1.2 mptp? -67.27 -45.53 76.37 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 118.459 0.572 . . . . 72.42 109.933 167.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.2 t -64.74 -21.63 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 123.732 0.813 . . . . 70.1 111.82 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 37.2 t -61.76 -30.86 71.07 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.422 0.689 . . . . 62.31 112.36 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 161.05 77.99 0.03 OUTLIER Glycine 0 CA--C 1.535 1.307 0 CA-C-O 120.195 -0.225 . . . . 75.53 112.977 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 28.4 t -103.53 115.36 30.38 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.303 0.641 . . . . 72.24 110.814 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -92.08 -11.32 36.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.206 0.602 . . . . 72.53 111.647 176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 57.63 74.2 0.43 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.841 1.257 . . . . 73.13 111.674 -176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.0 m -80.08 122.71 83.36 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 116.159 -0.473 . . . . 71.33 109.938 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -75.89 17.31 0.71 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 123.077 2.518 . . . . 74.43 114.035 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 . . . . . 0 CA--C 1.564 1.515 0 C-N-CA 123.945 0.898 . . . . 75.41 110.442 177.82 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.443 -0.577 . . . . 75.44 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.29 79.91 0.1 OUTLIER Glycine 0 N--CA 1.478 1.476 0 CA-C-O 120.05 -0.305 . . . . 72.14 112.969 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.514 ' HB3' HD12 ' A' ' 8' ' ' ILE . 23.8 t 64.16 -176.03 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.419 1.087 . . . . 62.52 112.357 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -93.83 107.79 19.64 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.554 -0.717 . . . . 74.45 109.844 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 113.365 0.876 . . . . 73.54 113.365 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.56 -42.58 99.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.966 0.348 . . . . 65.23 111.647 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -59.38 -44.39 92.76 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.938 0.495 . . . . 72.04 110.651 174.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' A' ' 3' ' ' SER . 90.8 mt -58.34 -45.77 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.744 0.818 . . . . 74.22 111.114 176.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.31 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.03 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.43 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.634 HG21 HD23 ' A' ' 101' ' ' LEU . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.41 110.63 170.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 72.4 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.22 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.609 HD23 ' HG ' ' A' ' 101' ' ' LEU . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.53 112.081 172.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.41 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.34 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 64.0 111.064 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.02 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 75.13 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 75.35 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 74.03 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 71.44 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.33 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.453 ' O ' HG22 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 73.41 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.647 HG22 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.42 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HB3' ' HZ3' ' A' ' 27' ' ' LYS . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.32 111.474 -175.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.44 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.545 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 74.1 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 72.52 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.63 ' HB3' ' HZ3' ' A' ' 31' ' ' LYS . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 74.44 111.35 164.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.11 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.13 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.2 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 74.4 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.573 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.32 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.411 ' HA ' HD21 ' A' ' 40' ' ' ASN . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.2 111.797 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.1 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.545 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.52 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' A' ' 37' ' ' GLU . 54.7 m-80 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.31 109.726 170.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.05 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 75.23 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.35 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.51 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.52 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.568 HG13 HD13 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 74.4 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 74.43 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 72.42 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.12 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.43 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.05 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.11 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.43 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 73.52 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.24 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.34 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.49 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 74.42 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.12 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.14 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.31 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.427 ' O ' HG21 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 75.04 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 73.43 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.568 HD13 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 72.4 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.23 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.427 HG21 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.22 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG12 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 74.13 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.05 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 60.5 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 73.13 110.783 -175.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.15 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 70.13 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.565 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.52 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.459 ' HE2' HG22 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 75.03 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.524 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 75.52 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 74.54 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 73.32 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.756 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 71.22 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.756 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.13 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 75.01 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.459 HG22 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 75.03 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.488 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.3 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 73.41 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.488 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 74.4 109.651 172.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.449 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 74.34 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 74.13 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 74.31 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.647 ' HG2' HG22 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 63.35 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 74.02 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.11 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.4 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.51 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 75.54 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.13 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 74.01 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.12 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 103' ' ' LYS . 20.3 tp10 -68.46 -39.11 81.56 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 73.12 111.398 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.634 HD23 HG21 ' A' ' 12' ' ' THR . 1.8 tm? -72.54 -29.5 63.63 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.379 0.672 . . . . 72.21 110.816 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.7 -38.57 78.55 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.775 0.83 . . . . 72.54 111.818 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 100' ' ' GLU . 51.1 mtpt -61.25 -25.43 67.07 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.142 0.977 . . . . 71.25 112.935 -179.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.4 mmtt -62.63 -42.49 99.62 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.317 0.647 . . . . 73.33 112.227 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.3 t -91.03 -69.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 109.723 -0.473 . . . . 75.25 109.723 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t 60.78 -76.9 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.084 1.354 . . . . 73.51 112.415 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.33 -156.03 20.22 Favored Glycine 0 C--N 1.352 1.461 0 O-C-N 122.364 -0.21 . . . . 70.42 113.083 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 78.3 p -88.72 165.44 14.74 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 75.13 111.599 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 64.0 -75.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.852 1.261 . . . . 72.41 112.351 -178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 78.9 mt -75.1 91.28 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.248 0.547 . . . . 74.24 111.239 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -129.28 147.25 64.26 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 124.335 1.054 . . . . 60.51 109.559 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -55.83 135.55 70.15 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 122.611 2.207 . . . . 74.43 112.976 173.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? . . . . . 0 CA--C 1.568 1.64 0 C-N-CA 124.1 0.96 . . . . 74.41 112.828 -172.553 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 tpt . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 119.808 -0.139 . . . . 75.51 110.893 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.54 -9.96 4.64 Favored Glycine 0 C--N 1.355 1.593 0 CA-C-O 119.544 -0.587 . . . . 62.23 114.482 175.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -77.43 73.84 4.0 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.895 0.855 . . . . 71.11 110.7 176.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.458 ' O ' HD13 ' A' ' 8' ' ' ILE . 30.3 t-80 -74.08 -39.38 63.47 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.029 -0.987 . . . . 74.24 111.005 -177.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -63.86 -31.47 72.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.978 0.511 . . . . 71.31 111.319 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.71 -39.23 62.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.842 0.857 . . . . 74.52 111.25 172.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -56.45 -38.53 71.77 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.867 0.867 . . . . 74.15 111.503 174.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.458 HD13 ' O ' ' A' ' 4' ' ' HIS . 1.4 mp -54.0 -50.61 52.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 C-N-CA 123.978 0.911 . . . . 63.33 110.721 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 75.15 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 73.4 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 71.13 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 73.11 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.34 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.13 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 71.12 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.473 ' HE2' ' HG ' ' A' ' 101' ' ' LEU . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.44 111.341 175.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.4 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.417 HD22 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 72.23 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.561 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.53 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 73.23 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.22 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 74.01 111.303 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 73.1 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.519 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.43 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.49 ' O ' HG21 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 70.24 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.518 HG22 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 74.13 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.519 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.44 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 74.32 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.517 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 74.33 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.35 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 75.24 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.31 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.43 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.1 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 74.35 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.409 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.4 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 60.35 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.517 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 75.11 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.44 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.477 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 74.3 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.34 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 75.02 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.34 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 65.21 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.514 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 70.24 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.34 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.417 ' HB ' HD22 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.41 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 62.45 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 75.4 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.23 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.13 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.443 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 65.02 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.02 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 74.21 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.43 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 53.43 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.443 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.42 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 71.32 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 64.21 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.421 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.51 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.12 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 75.1 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 75.32 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.514 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.43 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.41 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 75.24 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HB ' HG12 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.23 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 75.12 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.42 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.33 111.192 -176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 54.02 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.04 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.438 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 75.22 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.2 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.409 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.21 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 74.22 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.13 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 75.14 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.438 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.34 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.44 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.527 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 72.03 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.464 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 72.2 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 64.34 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.14 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 71.24 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.42 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.44 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 72.21 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.55 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.518 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 72.32 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 74.41 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.437 ' O ' HG21 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 75.02 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.561 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.45 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.3 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 74.51 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 71.42 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 74.21 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.76 -37.42 79.36 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.42 110.404 174.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.473 ' HG ' ' HE2' ' A' ' 16' ' ' LYS . 2.9 tm? -67.66 -34.93 77.91 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.678 0.791 . . . . 74.51 110.788 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -59.4 -48.94 79.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.632 0.373 . . . . 61.44 111.112 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.08 -31.97 72.83 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.638 0.375 . . . . 74.42 111.605 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.88 73.5 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 124.092 0.957 . . . . 73.43 110.523 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.2 m -90.47 -45.06 14.92 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.45 0 C-N-CA 122.64 0.376 . . . . 71.54 111.792 176.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -161.98 -65.7 0.05 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.215 1.006 . . . . 73.04 110.717 -178.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.29 130.82 2.89 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-N 115.711 -0.677 . . . . 71.12 112.066 -175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.0 m -75.72 85.52 2.73 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 117.577 0.688 . . . . 70.02 109.899 172.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -73.27 -34.05 65.59 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 115.105 -0.952 . . . . 74.11 111.275 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp 67.58 116.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.234 1.414 . . . . 74.31 112.547 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 15.4 m -60.94 111.74 4.63 Favored Pre-proline 0 CA--C 1.571 1.757 0 C-N-CA 123.239 0.616 . . . . 73.11 111.002 173.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 12.3 Cg_exo -71.64 -8.9 24.08 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 123.113 2.542 . . . . 65.44 114.522 -171.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 CA--C 1.572 1.794 0 CA-C-O 118.688 -0.672 . . . . 72.03 111.819 -175.405 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 120.312 0.101 . . . . 73.41 111.061 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.04 172.9 41.24 Favored Glycine 0 C--N 1.349 1.275 0 N-CA-C 113.655 0.222 . . . . 74.25 113.655 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 m -83.84 68.04 9.79 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.309 0.644 . . . . 62.43 111.375 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -79.91 103.22 9.66 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.886 0.474 . . . . 71.43 109.824 170.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -64.44 -31.02 72.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.15 0.58 . . . . 73.24 111.968 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.58 -41.72 99.12 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.501 0.72 . . . . 75.34 110.076 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.427 ' O ' HG23 ' A' ' 11' ' ' VAL . 82.6 t80 -60.5 -46.8 88.78 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.067 -0.97 . . . . 75.41 111.13 175.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.76 -36.43 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.444 0.698 . . . . 73.44 111.495 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.442 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.23 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 7' ' ' TYR . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 64.52 110.854 175.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.606 HG22 HD22 ' A' ' 101' ' ' LEU . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 70.32 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 74.13 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 71.43 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.32 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 75.22 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 74.32 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.24 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 73.21 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 72.04 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.13 111.94 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.55 HG13 HG21 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 70.5 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.13 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.23 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.48 ' O ' HG21 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.23 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 72.12 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.41 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.44 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 65.21 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 73.33 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.435 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 70.01 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.34 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 65.04 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 74.01 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.01 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.727 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 73.31 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 71.54 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.44 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.549 ' HB3' HG11 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 51.6 t30 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.12 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.45 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.55 HG21 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 73.12 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.33 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.2 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 75.53 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.574 HG11 HD13 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 74.22 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 74.41 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 64.32 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.1 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 71.52 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 73.3 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.13 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.521 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.31 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.21 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 75.31 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 74.52 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.14 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.521 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.34 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 74.42 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.44 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 74.33 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 64.31 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.426 ' O ' HG21 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 72.22 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 74.05 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.574 HD13 HG11 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 73.12 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.22 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.426 HG21 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 73.01 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.478 ' HB ' HG13 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.42 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 71.52 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.628 HD21 HD22 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.3 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.549 HG11 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.35 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 75.14 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.717 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 72.5 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.402 ' HB3' HG13 ' A' ' 82' ' ' ILE . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 73.41 112.083 178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.727 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 75.42 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.436 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.33 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.34 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.692 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.41 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.717 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 74.11 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.51 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.412 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 74.52 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.01 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.423 ' HA ' HD13 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.45 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 71.25 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.628 HD22 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 72.44 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.51 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.663 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 72.1 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 71.04 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.436 HG21 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.15 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.663 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 70.41 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 74.14 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 75.5 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 71.11 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.482 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 73.5 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.22 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.41 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 75.31 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 74.43 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -61.47 -54.26 45.76 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.34 111.265 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.606 HD22 HG22 ' A' ' 12' ' ' THR . 18.2 tp -70.12 -26.91 64.17 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 115.436 -0.802 . . . . 75.0 111.23 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.82 -45.6 91.84 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.31 110.734 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -56.77 -39.25 73.7 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.86 0.864 . . . . 75.44 111.256 174.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.87 -49.11 69.25 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.758 0.823 . . . . 73.33 112.342 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.21 -21.0 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 122.856 0.462 . . . . 64.52 111.859 -178.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.7 t -82.44 137.47 34.68 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.12 0.568 . . . . 71.33 110.748 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.73 82.88 0.21 Allowed Glycine 0 CA--C 1.534 1.271 0 N-CA-C 111.898 -0.481 . . . . 70.41 111.898 173.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.2 m -101.98 109.7 21.49 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.519 0.728 . . . . 73.22 110.878 -172.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -91.32 -68.82 0.77 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.963 0.505 . . . . 74.02 110.163 173.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.4 mp 63.57 113.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.817 1.247 . . . . 75.23 111.827 -176.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -59.58 147.56 77.09 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 123.671 0.788 . . . . 74.25 112.487 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.93 -29.55 40.94 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.663 2.242 . . . . 73.54 113.871 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? . . . . . 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 75.15 109.444 175.343 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 110.12 -0.326 . . . . 63.11 110.12 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -110.82 150.38 17.75 Favored Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.216 -0.354 . . . . 71.11 112.216 176.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -78.25 159.33 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.616 0.366 . . . . 71.51 110.753 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -62.32 -30.94 71.52 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.091 0.556 . . . . 63.41 111.543 173.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -63.41 -45.67 89.96 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.203 0.601 . . . . 74.52 111.195 172.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.578 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 17.3 tp10 -63.76 -37.41 87.25 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.944 0.898 . . . . 72.43 111.26 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.415 ' O ' HG22 ' A' ' 11' ' ' VAL . 71.8 t80 -60.89 -50.05 74.98 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.154 0.981 . . . . 74.15 110.762 174.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.442 HG21 ' HE3' ' A' ' 56' ' ' MET . 32.2 mm -60.27 -36.04 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.615 0.766 . . . . 73.24 112.187 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.578 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.35 111.578 173.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.31 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 7' ' ' TYR . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 72.15 112.158 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.43 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.22 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 70.34 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.01 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.22 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.54 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.41 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.54 111.57 174.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.22 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 75.34 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.42 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.53 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.498 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.41 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.474 ' O ' HG21 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.43 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.45 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.44 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.24 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.53 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 73.32 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 72.43 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.51 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.11 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.42 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.44 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.535 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 74.51 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.54 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.53 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 74.43 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 70.34 110.041 173.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 74.43 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.415 HG21 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 73.32 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.43 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 73.13 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.15 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 71.13 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 75.42 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.54 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.42 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 75.5 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.55 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 64.25 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.44 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 73.41 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.41 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.14 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.442 ' HE3' HG21 ' A' ' 8' ' ' ILE . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 73.11 111.991 172.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.44 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.02 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 70.14 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 70.43 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 63.1 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 54.55 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.24 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.41 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 74.42 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.44 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 70.11 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.496 HD13 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 73.43 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 74.51 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 74.22 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.42 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 74.24 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.13 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.661 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 74.44 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.521 ' HE3' HG22 ' A' ' 82' ' ' ILE . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 72.2 111.871 176.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.21 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.2 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 74.33 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.727 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.3 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.727 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.1 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.52 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.53 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.422 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 73.12 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.561 ' HA ' HD11 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 63.24 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.34 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.506 HD13 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.23 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.23 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.632 ' HA ' ' HZ1' ' A' ' 91' ' ' LYS . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 74.32 110.819 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.506 ' HD2' HD13 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 74.02 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 72.33 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.632 ' HZ1' ' HA ' ' A' ' 88' ' ' ASP . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.05 111.794 173.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.488 ' HB2' ' HZ2' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 75.34 112.699 -176.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.496 ' HB3' HD13 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 71.05 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 53.02 110.651 177.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.13 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 73.43 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.54 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 75.34 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.468 ' O ' ' HD3' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.45 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -41.95 80.4 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 75.32 109.729 174.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 114.97 -1.014 . . . . 75.51 111.219 173.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.04 -39.31 66.09 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.961 0.904 . . . . 65.44 111.851 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -67.37 -53.3 30.56 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.478 0.711 . . . . 75.43 111.846 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.92 -18.89 61.35 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.247 0.832 . . . . 73.35 113.247 -169.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 94.2 t -87.34 -37.95 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.243 0.617 . . . . 72.32 110.972 174.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 83.8 p -65.58 -27.47 68.45 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.574 0.35 . . . . 73.14 111.813 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.39 121.23 5.67 Favored Glycine 0 CA--C 1.537 1.433 0 N-CA-C 111.143 -0.783 . . . . 65.43 111.143 167.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 71.0 m -71.39 96.35 1.46 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 117.41 0.605 . . . . 72.4 112.383 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -161.18 162.55 31.35 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.72 0.808 . . . . 75.12 110.14 171.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.82 37.9 21.79 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.782 1.233 . . . . 72.5 112.011 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 23.7 m -62.01 134.54 94.38 Favored Pre-proline 0 CA--C 1.566 1.589 0 CA-C-N 115.393 -0.822 . . . . 74.53 111.736 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 24.3 Cg_exo -65.64 -11.03 28.73 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.978 2.452 . . . . 62.23 114.679 -175.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? . . . . . 0 CA--C 1.561 1.392 0 C-N-CA 123.736 0.815 . . . . 74.14 110.728 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 110.825 -0.065 . . . . 74.21 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.02 72.18 1.63 Allowed Glycine 0 C--N 1.354 1.578 0 O-C-N 123.173 0.295 . . . . 73.43 113.055 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 114.5 6.72 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.906 0.882 . . . . 71.5 111.371 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 68.82 27.03 5.81 Favored 'General case' 0 CA--C 1.568 1.649 0 C-N-CA 124.157 0.983 . . . . 74.54 111.934 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.635 0.774 . . . . 74.12 111.966 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.564 ' HB3' ' HZ2' ' A' ' 10' ' ' LYS . 41.0 mt-10 -56.52 -31.74 64.41 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.192 0.997 . . . . 74.14 113.489 -174.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -54.31 -47.14 72.77 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.4 0.68 . . . . 71.02 111.471 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm -59.66 -38.83 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 C-N-CA 123.951 0.9 . . . . 74.31 111.581 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.11 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.564 ' HZ2' ' HB3' ' A' ' 6' ' ' GLU . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 75.04 111.158 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.02 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 74.44 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.32 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 70.11 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 73.31 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.23 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 64.45 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 62.34 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.444 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.31 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 74.04 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.42 111.85 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.421 HG13 HG21 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.52 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.451 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.24 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.31 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 72.25 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.425 HG22 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 63.25 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 75.1 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.42 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.513 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.45 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.11 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 74.01 111.538 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.33 110.588 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 75.21 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.4 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.724 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.24 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.22 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.45 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.513 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.15 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.01 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.689 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.1 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.421 HG21 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.42 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.23 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.689 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 75.0 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 74.41 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.578 HG13 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.02 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.31 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.429 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 74.54 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 75.51 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 72.52 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.01 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.44 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.473 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 72.23 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.03 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 55.44 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.31 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.32 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.473 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.43 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.35 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.41 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.14 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 64.34 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HZ1' ' HB3' ' A' ' 63' ' ' LYS . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.51 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 71.41 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.13 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 73.55 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.582 HD13 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 72.22 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.32 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.34 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 73.41 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.33 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.44 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.459 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.42 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.579 ' HE3' HG21 ' A' ' 82' ' ' ILE . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 74.2 112.519 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.724 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.15 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 72.24 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.42 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 75.0 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.459 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 73.21 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.23 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.579 HG21 ' HE3' ' A' ' 75' ' ' MET . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.03 108.767 177.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.414 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.14 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 64.34 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.23 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.33 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.14 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.53 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.44 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.428 HG13 HG22 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 74.54 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.425 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 75.43 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 74.4 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.582 ' HB3' HD13 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 74.24 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.444 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 72.23 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 74.04 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.31 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.15 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 75.02 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -66.54 -44.01 83.59 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.33 110.212 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.1 tp -72.32 -41.85 66.1 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.278 0.631 . . . . 72.24 111.188 176.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.1 -25.85 65.52 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.271 0.629 . . . . 72.41 111.46 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -57.95 -35.0 70.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.356 0.663 . . . . 75.42 111.011 173.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -77.44 -30.24 53.25 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.863 0.865 . . . . 74.33 111.87 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.7 -66.03 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.55 0.74 . . . . 72.4 110.163 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.4 m -76.54 81.37 3.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.096 0.958 . . . . 75.24 110.867 172.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.62 -145.68 11.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 115.789 -0.641 . . . . 62.13 112.671 176.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.5 m 52.02 66.56 1.17 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.183 0.993 . . . . 71.02 111.483 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 61.03 -82.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.73 1.212 . . . . 75.54 111.17 -173.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.69 164.86 36.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.33 1.052 . . . . 75.4 111.039 177.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.57 147.93 64.6 Favored Pre-proline 0 N--CA 1.486 1.36 0 C-N-CA 123.263 0.625 . . . . 75.42 111.681 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.97 105.64 0.15 Allowed 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.19 2.593 . . . . 73.11 113.113 175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.352 0 C-N-CA 123.769 0.828 . . . . 71.32 109.039 -174.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.509 0.195 . . . . 73.22 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.63 -100.04 0.56 Allowed Glycine 0 CA--C 1.539 1.552 0 N-CA-C 113.954 0.342 . . . . 65.01 113.954 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 t -87.42 172.09 10.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.535 0.734 . . . . 75.53 112.575 -175.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -115.67 176.18 5.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 123.684 0.793 . . . . 72.53 112.088 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -62.87 -30.74 71.75 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.624 1.169 . . . . 74.24 113.898 -175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -68.15 -29.99 69.0 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.417 0.525 . . . . 74.25 112.417 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 11' ' ' VAL . 87.2 t80 -62.49 -49.08 76.8 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.387 0.675 . . . . 75.13 110.84 173.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.496 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm -59.69 -41.54 85.6 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.234 0 C-N-CA 123.865 0.866 . . . . 74.42 110.797 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 72.4 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.35 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.23 111.794 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.493 HG22 HD23 ' A' ' 101' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 71.45 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.32 113.413 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.33 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.421 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.33 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.44 111.456 -173.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.12 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.11 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.13 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.21 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.32 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.53 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.43 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.43 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.54 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.438 ' O ' HG21 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.22 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.448 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.23 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 73.52 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.41 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.545 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 65.43 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.35 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 74.41 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.52 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 72.14 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.46 ' HA ' HD12 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.31 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 71.34 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.596 ' HE1' ' HA ' ' A' ' 36' ' ' MET . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.04 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.01 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 72.45 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.545 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.43 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 72.2 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 75.22 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.31 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.51 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 74.35 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.12 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.635 HG12 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.42 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 74.03 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.31 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.15 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 71.35 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.54 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.1 110.363 175.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.53 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.44 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.496 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 73.5 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.42 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.487 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.53 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 74.11 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.43 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.436 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 72.21 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.32 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.441 ' O ' HG21 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 75.15 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 74.5 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.415 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 53.3 t-80 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 71.43 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.441 HG21 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.42 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG12 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.2 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.415 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 74.2 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.41 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.11 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 74.31 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.13 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.468 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 75.34 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.432 ' HB3' ' HE2' ' A' ' 36' ' ' MET . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 73.13 111.343 174.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.576 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.32 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 55.42 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.53 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.684 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.24 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.684 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.54 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 75.32 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.495 HG23 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 75.45 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.423 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 72.32 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.495 ' H ' HG23 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 74.52 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.44 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.423 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.13 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 73.0 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 72.24 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 72.41 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.02 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.448 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.23 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.53 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.458 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 74.21 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 75.31 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.402 ' O ' ' HG3' ' A' ' 99' ' ' ARG . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.14 109.279 170.261 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 71.51 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 74.01 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 74.21 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.402 ' HG3' ' O ' ' A' ' 95' ' ' ASP . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.33 111.821 -178.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.37 -41.63 76.27 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.41 110.549 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.493 HD23 HG22 ' A' ' 12' ' ' THR . 0.4 OUTLIER -70.23 -37.17 74.93 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 122.979 0.512 . . . . 64.52 110.075 176.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.69 -36.13 75.86 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.75 0.82 . . . . 73.22 110.803 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -84.74 -22.92 29.5 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 123.972 0.909 . . . . 74.42 111.52 176.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -71.25 -37.86 71.93 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.807 0.843 . . . . 74.3 111.712 -175.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.1 m -65.16 -23.43 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.164 0.586 . . . . 75.01 111.687 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.0 t -87.7 90.68 8.47 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.267 0.627 . . . . 44.22 109.448 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.31 144.91 6.88 Favored Glycine 0 N--CA 1.479 1.538 0 CA-C-N 115.718 -0.674 . . . . 64.41 112.381 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 44.6 t -89.46 91.87 8.89 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-O 121.355 0.598 . . . . 71.23 111.008 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -96.37 33.5 1.77 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.133 0.973 . . . . 74.14 111.701 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.7 mp -86.87 54.05 3.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.798 0.839 . . . . 75.23 110.509 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.7 m -113.97 134.25 22.18 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 123.729 0.812 . . . . 75.45 110.991 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.61 -9.4 14.71 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.396 2.064 . . . . 75.23 112.38 171.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 . . . . . 0 CA--C 1.56 1.336 0 C-N-CA 124.127 0.971 . . . . 73.45 109.711 -179.333 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.8 ptp . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.863 0.363 . . . . 74.03 111.047 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.26 -123.71 1.22 Allowed Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.664 -0.52 . . . . 45.01 111.984 -176.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.8 m 61.27 -88.04 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.614 1.166 . . . . 74.22 110.791 -172.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 49.97 110.49 0.0 OUTLIER 'General case' 0 C--N 1.369 1.414 0 C-N-CA 125.362 1.465 . . . . 73.41 114.154 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -54.26 -29.0 45.29 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.375 0.67 . . . . 73.22 111.967 175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.77 -54.34 48.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.999 0.92 . . . . 75.15 110.543 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.09 -40.09 88.38 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.405 1.082 . . . . 74.21 111.547 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm -64.21 -45.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.384 0.674 . . . . 72.23 111.308 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.51 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 75.42 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.4 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.453 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.51 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.537 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.52 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.22 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.52 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.537 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 75.15 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 71.22 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 75.31 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.42 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.44 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.463 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.21 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.13 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.424 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 73.25 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.487 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 71.4 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.473 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.43 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 72.24 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.14 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.512 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 64.44 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.14 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HZ1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 71.35 111.509 174.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 71.5 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.32 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.44 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 75.13 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.54 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.512 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.24 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.23 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 71.33 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 73.33 111.111 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 75.53 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.01 112.271 -178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 75.31 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD13 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 73.43 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.401 ' HD2' ' HE3' ' A' ' 69' ' ' MET . 46.6 t-80 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.11 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 74.0 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 74.43 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.3 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.52 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 63.03 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.507 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 72.22 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.1 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.31 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 75.44 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.507 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.33 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.33 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 70.02 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.24 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.04 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.484 ' O ' HG21 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.32 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.565 HD13 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.55 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.14 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.484 HG21 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 74.34 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 75.43 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.401 ' HE3' ' HD2' ' A' ' 47' ' ' HIS . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.25 110.402 175.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.12 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 74.43 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 75.1 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 75.12 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.23 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.438 ' HB3' ' HE1' ' A' ' 36' ' ' MET . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 74.33 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 74.44 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.499 HD21 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.43 111.701 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.53 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.52 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.34 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.52 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 75.35 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 73.3 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.21 109.821 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 75.31 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.421 ' HA ' HD13 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.52 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 74.4 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.51 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.35 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.05 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 74.24 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.417 ' HG2' HG22 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.11 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.33 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.42 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 75.34 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.23 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 72.1 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.51 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 74.05 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.51 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -34.67 61.19 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 75.34 109.568 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 tp -72.35 -29.45 63.81 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-O 121.021 0.439 . . . . 74.33 110.765 171.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.06 -32.59 73.04 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.632 0.773 . . . . 74.04 110.631 175.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.1 mmtm -64.6 -27.88 69.25 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.786 0.834 . . . . 74.4 112.078 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -69.86 -47.84 61.11 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.205 0.526 . . . . 75.32 110.352 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 58.2 t -65.69 -38.59 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.888 0.875 . . . . 74.25 111.18 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.1 t -74.38 -26.14 59.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.904 0.882 . . . . 55.41 112.003 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.55 68.36 1.52 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.572 -0.285 . . . . 71.14 112.463 -178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.8 t -151.54 122.4 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.304 0.641 . . . . 75.14 110.392 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.58 137.68 40.95 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.705 0.802 . . . . 74.11 111.528 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.498 HD21 ' H ' ' A' ' 110' ' ' LEU . 2.4 pt? -79.59 132.7 36.34 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.391 0.676 . . . . 74.33 111.25 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 14.9 m -130.72 159.3 71.73 Favored Pre-proline 0 N--CA 1.492 1.667 0 C-N-CA 124.748 1.219 . . . . 74.34 110.8 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.7 82.33 0.32 Allowed 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 122.734 2.29 . . . . 74.1 114.081 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 . . . . . 0 CA--C 1.56 1.357 0 C-N-CA 124.271 1.029 . . . . 70.15 109.854 173.849 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtt . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.895 -0.409 . . . . 64.04 109.895 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.66 -123.08 4.09 Favored Glycine 0 N--CA 1.476 1.355 0 CA-C-O 119.86 -0.411 . . . . 74.33 112.369 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.0 p -68.62 99.1 0.95 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.437 0.695 . . . . 75.2 112.567 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -70.95 103.74 2.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.111 0.564 . . . . 75.12 110.943 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.497 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 49.3 mt-30 -64.51 -38.66 91.79 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.494 0.718 . . . . 74.2 110.887 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -50.57 -47.32 57.91 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.967 1.307 . . . . 75.22 111.818 173.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.419 ' O ' HG22 ' A' ' 11' ' ' VAL . 67.1 t80 -59.84 -50.08 75.2 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.003 -0.998 . . . . 72.21 111.003 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -57.5 -45.06 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 123.931 0.892 . . . . 73.12 112.463 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.497 ' HD3' ' O ' ' A' ' 5' ' ' GLN . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.3 111.394 178.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 73.32 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.419 HG22 ' O ' ' A' ' 7' ' ' TYR . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 74.22 112.87 -176.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.452 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 70.22 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 72.3 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.21 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD23 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.41 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.14 111.196 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.22 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD22 ' HB ' ' A' ' 48' ' ' THR . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.13 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.53 HG23 HD11 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 74.24 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.34 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.23 112.075 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 63.41 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.41 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 61.43 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 75.03 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.573 HG22 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.05 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.4 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 75.45 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.444 HG13 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.52 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.1 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 74.05 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.4 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.11 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 71.41 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.02 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.626 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.52 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.51 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 74.14 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.444 ' CE2' HG13 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.43 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.01 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 73.41 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 74.35 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 75.43 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 75.12 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.31 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.41 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 71.4 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.41 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.14 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 73.23 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 73.34 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 72.32 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.34 112.655 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.42 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.43 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.13 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 65.22 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.04 111.096 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.23 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.34 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 74.12 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 60.05 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 75.13 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.14 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.4 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 74.02 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.553 ' HB ' HG12 ' A' ' 46' ' ' VAL . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 72.45 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 71.33 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 72.23 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 72.13 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.41 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 65.32 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.41 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.537 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 74.12 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.626 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 73.31 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 71.31 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.4 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.445 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.31 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.445 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.14 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.533 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.44 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.533 ' H ' ' HG2' ' A' ' 81' ' ' LYS . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.45 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.626 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 71.33 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.13 113.265 177.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 71.12 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.626 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.53 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.03 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.42 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 73.3 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.416 HG12 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.12 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.573 ' HG2' HG22 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 74.42 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.728 ' HZ1' ' HB2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 61.23 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.455 ' O ' HG22 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 74.04 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.53 HD11 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 72.11 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 72.43 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.477 HG12 HD23 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.43 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.53 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.427 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 64.12 112.39 -173.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.467 ' O ' ' HB3' ' A' ' 103' ' ' LYS . 0.8 OUTLIER -80.37 -30.32 37.89 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 23.7 tp -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.436 0.636 . . . . 74.12 110.244 173.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.427 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 30.0 t70 -59.88 -29.47 68.34 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.078 0.951 . . . . 55.14 111.405 168.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.652 ' HG3' ' HB3' ' A' ' 109' ' ' TYR . 37.8 ttpt -73.78 -32.75 63.94 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.965 0.906 . . . . 74.05 111.872 173.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -48.29 79.71 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 123.325 0.65 . . . . 75.04 110.623 174.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.3 m -75.63 -21.16 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 CA-C-N 116.178 -0.465 . . . . 61.32 111.801 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 43.9 t -67.17 -18.06 65.11 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.367 0.667 . . . . 73.1 111.463 170.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.37 -60.08 4.35 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 111.611 -0.595 . . . . 60.02 111.611 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.6 t -156.65 92.73 1.32 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.586 0.755 . . . . 74.12 110.046 175.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.652 ' HB3' ' HG3' ' A' ' 103' ' ' LYS . 38.2 t80 -89.56 -63.65 1.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.978 0.511 . . . . 73.53 109.703 173.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.9 mt -132.93 108.0 8.65 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.582 0.753 . . . . 74.13 110.703 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -75.47 135.85 71.95 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.444 0.698 . . . . 74.02 111.903 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.09 94.76 0.96 Allowed 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.419 2.079 . . . . 72.25 113.074 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 . . . . . 0 CA--C 1.561 1.4 0 C-N-CA 124.116 0.966 . . . . 72.54 109.992 175.078 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 120.491 0.186 . . . . 74.25 111.029 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.84 115.64 0.44 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-O 119.559 -0.579 . . . . 71.42 112.195 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.11 -62.02 2.07 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 117.221 0.511 . . . . 73.34 111.326 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -140.39 -65.83 0.45 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.072 0.549 . . . . 63.11 111.535 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -64.95 -42.17 94.85 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.71 0.804 . . . . 73.45 111.056 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.415 ' HB3' ' HZ1' ' A' ' 10' ' ' LYS . 57.4 mm-40 -64.75 -38.24 90.31 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.703 -0.68 . . . . 70.55 112.007 174.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.3 -50.0 69.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.621 0.368 . . . . 75.23 110.99 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm -60.71 -41.74 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 123.635 0.774 . . . . 75.12 110.777 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 71.22 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HZ1' ' HB3' ' A' ' 6' ' ' GLU . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.42 112.569 -178.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.35 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 74.53 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.559 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 73.12 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.2 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.21 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.559 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.45 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.41 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 73.31 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.439 ' HA ' HD22 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.45 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 71.25 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 75.31 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 74.31 111.924 179.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 75.54 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.22 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.539 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.4 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.41 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.33 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 74.15 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 74.31 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.04 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.01 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.482 ' HA ' HG13 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 75.45 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.21 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.32 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.57 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.54 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 70.1 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.33 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.447 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.35 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 75.54 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.43 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 74.22 112.024 178.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.1 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 73.22 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.429 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 75.32 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.567 HG13 HD11 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 75.34 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 71.12 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.21 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.15 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HE3' ' HD2' ' A' ' 66' ' ' HIS . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 74.1 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 75.02 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 74.31 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.51 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 74.22 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 72.15 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.03 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.43 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 71.45 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.51 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.14 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.52 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.23 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 74.45 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.31 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.45 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 75.23 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.567 HD11 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.44 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.437 ' HD2' ' HE3' ' A' ' 50' ' ' LYS . 57.5 t-80 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 75.15 110.952 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 73.22 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.452 ' HB ' HG12 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.43 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 75.54 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.33 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.34 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 74.14 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.03 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.22 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 72.23 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.57 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.22 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.468 HD21 ' HG2' ' A' ' 79' ' ' GLU . 0.4 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.31 112.233 -178.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 64.34 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.718 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 73.12 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.718 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 74.24 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 72.41 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 64.55 109.432 -174.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.52 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 74.54 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.31 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.447 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 73.14 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.41 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 71.2 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.42 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 74.33 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.31 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.418 ' O ' HG21 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 74.43 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.13 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.23 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.42 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.418 HG21 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.11 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 74.21 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.44 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -76.65 -27.99 55.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 73.24 110.917 178.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 ' HD3' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.43 -40.93 70.11 Favored 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 121.496 0.665 . . . . 73.41 109.364 173.416 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.65 -41.88 98.18 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.466 0.706 . . . . 70.34 110.396 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -64.17 -50.75 66.91 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.733 1.213 . . . . 73.0 112.242 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.459 ' HD3' HD22 ' A' ' 101' ' ' LEU . 0.0 OUTLIER -57.27 -30.07 64.37 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 113.824 1.046 . . . . 73.51 113.824 -168.591 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.65 -39.49 83.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.243 0 C-N-CA 123.344 0.658 . . . . 75.01 111.241 178.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 70.2 m -112.16 16.53 20.09 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.812 0.845 . . . . 62.2 111.583 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.18 101.7 2.11 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 116.508 -0.314 . . . . 74.41 113.525 -173.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 59.8 m -70.43 160.9 31.51 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.403 0.681 . . . . 74.04 111.705 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -82.13 97.61 8.28 Favored 'General case' 0 CA--C 1.562 1.431 0 CA-C-O 121.615 0.722 . . . . 71.3 110.09 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.6 mp -81.34 138.76 35.64 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 121.778 -0.576 . . . . 65.35 110.895 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.5 m -61.84 153.68 71.06 Favored Pre-proline 0 CA--C 1.566 1.558 0 C-N-CA 123.453 0.701 . . . . 75.53 110.983 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -65.2 84.21 0.19 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.466 2.111 . . . . 72.43 112.113 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 124.771 1.228 . . . . 74.3 110.185 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.463 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 110.459 -0.2 . . . . 74.45 110.459 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.62 125.52 37.25 Favored Glycine 0 CA--C 1.54 1.604 0 O-C-N 123.579 0.549 . . . . 73.14 113.347 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 t -73.04 78.16 1.21 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.665 0.786 . . . . 71.05 111.07 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -138.95 148.81 44.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.961 0.904 . . . . 71.45 111.243 -175.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -67.51 -29.11 68.44 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.562 0.745 . . . . 73.24 110.285 169.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -55.23 -37.91 67.79 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.671 1.188 . . . . 73.35 112.532 172.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -58.96 -48.25 82.2 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.443 0.697 . . . . 75.12 110.53 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.16 -38.32 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 114.832 -1.076 . . . . 73.41 111.639 -177.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 71.53 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 74.11 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.466 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 73.2 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.22 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.43 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 72.4 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.597 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 73.12 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.597 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 75.44 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.12 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 73.13 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.12 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 71.4 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 72.04 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.432 HG13 HG21 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.43 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.12 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.23 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.488 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 74.4 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.578 HG22 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.44 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 73.51 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.32 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.595 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 71.44 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.32 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 73.32 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.4 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 75.22 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.41 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.463 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.54 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.55 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.43 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.595 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.52 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.45 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.41 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.488 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 73.41 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.42 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 72.23 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.33 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.541 HG13 HD13 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 71.34 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 74.05 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.34 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 74.13 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.54 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 75.33 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 75.22 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 72.21 111.885 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.53 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.42 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.31 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.24 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 73.13 111.46 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.44 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.1 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.31 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 52.52 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 71.21 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.53 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.541 HD13 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.14 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.33 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 73.15 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.46 HG21 HG22 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 72.33 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 71.12 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.34 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 73.45 110.762 -179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.491 HG11 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.35 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 72.11 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.678 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 74.41 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.674 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 75.11 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.24 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 60.32 110.699 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 75.41 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.634 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 71.42 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.678 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.4 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 75.35 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.674 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.21 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.3 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.24 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.52 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 74.22 111.454 175.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 75.51 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.53 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.44 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.436 HG12 HG22 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.12 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.578 ' HG2' HG22 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 74.11 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.11 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.412 ' O ' HG21 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.53 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 75.24 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 75.14 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.461 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.01 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.412 HG21 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 74.24 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.45 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.24 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 -63.09 -43.49 98.36 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 61.53 111.702 -176.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.09 -43.06 65.39 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 122.678 0.391 . . . . 72.43 110.399 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -67.05 -25.87 66.47 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.043 0.537 . . . . 64.54 112.28 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -76.25 -36.58 58.41 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.176 0.991 . . . . 74.11 110.402 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -59.74 -37.04 77.88 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.616 0.766 . . . . 71.41 111.159 172.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.7 t -69.35 -68.32 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.168 0.587 . . . . 74.15 109.85 171.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 69.0 m -151.09 -70.04 0.17 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.218 1.007 . . . . 74.54 109.824 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.09 -94.04 0.17 Allowed Glycine 0 C--N 1.354 1.548 0 CA-C-N 115.984 -0.553 . . . . 62.13 113.765 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t 67.6 171.62 0.27 Allowed 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.459 1.504 . . . . 74.33 113.518 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -140.5 84.44 1.95 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 124.382 1.073 . . . . 72.3 110.149 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -73.97 106.55 5.72 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.822 -0.548 . . . . 72.54 109.66 -177.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.7 m -96.98 143.03 25.42 Favored Pre-proline 0 CA--C 1.563 1.457 0 C-N-CA 123.774 0.83 . . . . 71.34 110.644 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.86 -1.56 11.7 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.521 2.148 . . . . 73.21 113.845 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 . . . . . 0 CA--C 1.571 1.776 0 C-N-CA 123.922 0.889 . . . . 73.33 111.114 178.138 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 ttm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 110.585 -0.154 . . . . 74.13 110.585 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.27 71.14 2.5 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.178 0.299 . . . . 54.33 112.577 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -82.23 136.59 35.06 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.719 0.808 . . . . 74.23 111.352 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -131.73 144.31 50.88 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.604 0.761 . . . . 62.32 110.334 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -68.37 -34.55 76.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.704 0.402 . . . . 75.55 111.167 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.49 -35.37 75.78 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.201 0.6 . . . . 73.43 111.873 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -57.63 -52.28 66.06 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.157 0.583 . . . . 72.45 110.176 170.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.54 HG22 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt -57.68 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.916 0.886 . . . . 65.24 111.052 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 64.44 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 75.14 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.566 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.22 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.42 111.189 165.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.32 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 75.24 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.516 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 75.05 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.516 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.24 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.34 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.33 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.437 HG22 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.1 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 70.14 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 73.23 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.21 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 71.21 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.55 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.2 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.01 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.44 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.05 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.23 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.54 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 72.33 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.51 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 72.21 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 72.44 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.33 112.443 -173.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.11 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.54 ' HA ' ' HE2' ' A' ' 36' ' ' MET . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.02 111.984 -173.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.44 ' HA ' HD21 ' A' ' 40' ' ' ASN . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 73.22 111.377 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 75.52 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.33 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.44 HD21 ' HA ' ' A' ' 37' ' ' GLU . 58.1 m-80 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.21 110.222 170.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HZ2' ' HG2' ' A' ' 37' ' ' GLU . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.24 111.132 174.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.412 HG21 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 75.31 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.13 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.45 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.44 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.618 HG12 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.53 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 73.11 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.42 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 73.34 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 74.32 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.4 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.409 ' O ' HG21 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.51 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 54.31 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 74.3 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.409 HG21 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 74.22 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.54 ' SD ' HG22 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 71.41 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 71.25 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.22 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 75.35 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.23 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.6 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 71.21 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.02 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.45 ' O ' HG21 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.32 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 73.21 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.599 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 73.35 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 75.13 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.45 HG21 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.02 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.618 ' HB ' HG12 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 74.31 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.498 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.55 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.34 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 65.21 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 75.32 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 73.43 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 71.33 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.458 ' HB3' HD12 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 74.23 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 74.03 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 72.42 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.23 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.31 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 65.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.458 HD12 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 73.33 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.469 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.2 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 74.3 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.469 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 74.51 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.45 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.2 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 74.23 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 75.15 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 73.21 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 73.42 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.403 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.45 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.411 ' O ' HG21 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.33 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.437 ' HG ' HG22 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.23 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.03 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.51 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.14 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.21 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.403 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.54 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 -58.87 -46.77 87.0 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.24 110.874 174.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.406 ' O ' HG22 ' A' ' 105' ' ' VAL . 59.7 tp -70.99 -34.2 71.15 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.607 -0.724 . . . . 73.34 111.161 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.66 -54.34 48.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.797 0.839 . . . . 72.42 111.357 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -72.98 -18.44 61.36 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.33 0.652 . . . . 74.13 112.042 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -67.42 -41.72 84.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.004 0.522 . . . . 75.15 111.058 173.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 101' ' ' LEU . 87.6 t -63.83 -32.0 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.462 0.705 . . . . 63.41 110.955 175.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.0 m -64.32 152.69 40.53 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.125 0.57 . . . . 75.21 112.002 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.52 -84.6 0.49 Allowed Glycine 0 N--CA 1.476 1.346 0 CA-C-N 116.101 -0.5 . . . . 74.25 112.23 -179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.7 t -171.77 -59.16 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.692 0.797 . . . . 72.52 111.361 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.6 t80 74.69 -31.35 0.21 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.855 1.662 . . . . 75.24 113.053 -173.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.97 -47.02 84.98 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.295 0.638 . . . . 71.14 110.833 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.8 m -102.69 115.77 63.76 Favored Pre-proline 0 CA--C 1.564 1.492 0 C-N-CA 123.193 0.597 . . . . 75.41 110.839 175.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -80.19 165.36 21.43 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.85 2.367 . . . . 75.44 112.194 170.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 N--CA 1.497 1.886 0 C-N-CA 125.072 1.349 . . . . 73.34 112.303 177.13 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.479 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.493 1.692 0 N-CA-C 110.556 -0.164 . . . . 63.32 110.556 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.97 121.04 1.21 Allowed Glycine 0 C--N 1.35 1.338 0 CA-C-O 120.011 -0.327 . . . . 75.44 113.365 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.2 t -91.75 171.69 8.98 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.575 0.75 . . . . 73.1 110.813 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -87.3 100.79 12.97 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 63.34 111.127 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -70.03 -30.92 68.32 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.231 0.612 . . . . 74.15 111.782 178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 14.3 tp10 -62.71 -32.65 73.79 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.412 0.685 . . . . 72.43 111.481 176.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -68.04 -42.89 79.88 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.73 0.812 . . . . 70.44 110.813 173.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm -60.61 -43.02 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.18 0.592 . . . . 64.04 110.933 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.515 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 74.02 111.328 171.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 63.35 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 73.32 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 72.44 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.33 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.02 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.421 HD23 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.11 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 75.42 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.52 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.487 HD22 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 73.05 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.52 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.11 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.21 111.999 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.572 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.03 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.12 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.721 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.43 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.41 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.449 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.14 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.721 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.53 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.53 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.541 HG12 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.2 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 64.12 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 72.32 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.14 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 75.31 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 75.34 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.52 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.585 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.45 113.467 -170.298 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.479 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 70.14 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.14 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.541 ' CZ2' HG12 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 74.51 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.479 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 72.11 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.482 ' HZ1' ' HB3' ' A' ' 41' ' ' LYS . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.53 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.572 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.43 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.04 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.3 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 73.11 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.02 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.22 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD22 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.42 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.12 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.402 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.42 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 74.14 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 74.5 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.417 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.31 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.44 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 74.15 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 74.22 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.11 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.43 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.11 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.52 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.417 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 71.42 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 63.24 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' O ' HG21 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.51 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.42 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 73.21 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 75.45 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 63.22 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.428 HD13 ' H ' ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.45 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.402 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 75.25 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 61.24 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.32 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 74.21 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.04 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.602 ' HE2' HG22 ' A' ' 82' ' ' ILE . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 65.54 111.747 174.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 73.42 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 61.01 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 75.51 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.593 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 75.31 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.593 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 75.31 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 73.52 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.602 HG22 ' HE2' ' A' ' 75' ' ' MET . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 74.34 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.13 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' HD13 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 54.22 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.23 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.33 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 HG11 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.24 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.42 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.03 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.33 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.449 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.41 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 75.23 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.34 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.42 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 71.14 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.421 HG12 HD23 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.41 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 74.52 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.13 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.56 -26.83 41.3 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.32 111.229 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.35 -30.54 70.95 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 109.626 -0.509 . . . . 74.5 109.626 173.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -57.34 -37.13 72.08 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 123.572 0.749 . . . . 63.31 111.258 171.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -71.71 -35.02 70.07 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.56 0.744 . . . . 73.12 111.27 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.17 89.51 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.524 0.729 . . . . 75.33 110.153 176.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 92.7 t -69.74 -55.58 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.588 0.755 . . . . 71.44 110.885 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m 60.21 94.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.577 1.151 . . . . 70.13 110.689 -170.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.32 75.91 1.14 Allowed Glycine 0 C--N 1.349 1.302 0 C-N-CA 122.967 0.317 . . . . 62.23 113.399 -175.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.0 t 65.6 1.39 1.72 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 125.648 1.579 . . . . 72.43 113.411 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -99.27 109.61 22.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.406 0.682 . . . . 74.34 110.873 -176.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 mp -110.51 -174.82 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.158 0.983 . . . . 74.4 109.92 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.4 m -120.8 153.36 56.98 Favored Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 123.572 0.749 . . . . 72.01 110.984 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -67.28 103.38 0.77 Allowed 'Trans proline' 0 C--N 1.383 2.35 0 C-N-CA 122.517 2.145 . . . . 71.44 112.206 174.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 . . . . . 0 CA--C 1.572 1.791 0 C-N-CA 125.018 1.327 . . . . 71.54 112.031 -178.831 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.485 1.289 0 N-CA-C 110.012 -0.366 . . . . 73.32 110.012 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.54 -114.21 6.64 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 116.082 -0.508 . . . . 54.33 112.951 -177.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.6 t -167.6 137.61 2.79 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.639 0.776 . . . . 74.44 111.541 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -127.71 172.22 10.99 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.686 1.195 . . . . 73.13 109.788 170.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.13 -40.92 74.52 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 112.978 0.732 . . . . 73.31 112.978 -175.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.486 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 15.1 tp10 -68.7 -42.7 77.38 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.216 0.607 . . . . 74.02 111.112 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -57.16 -42.83 81.81 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.822 0.849 . . . . 74.33 110.72 172.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.78 -49.31 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.301 1.04 . . . . 75.45 111.013 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.486 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.42 111.557 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.574 ' HB3' ' HZ2' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.34 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 54.33 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.23 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 71.33 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.33 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.43 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 74.31 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 75.3 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.2 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.31 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.412 ' HA ' HD13 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 72.11 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 75.23 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.43 112.088 178.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.32 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.51 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.446 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 64.32 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.53 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.01 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.446 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.32 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 74.51 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.475 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.12 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.22 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 74.43 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 73.42 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.44 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.02 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.01 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.486 ' HE3' ' HB3' ' A' ' 75' ' ' MET . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.2 112.514 -177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.42 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.14 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.475 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.34 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.04 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.415 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 73.43 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 73.33 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 72.25 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 70.3 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.13 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.483 HG12 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.24 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 64.04 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.448 ' HB ' HD22 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.33 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.51 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.15 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 73.14 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.461 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 74.13 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.429 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 73.54 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 72.5 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.55 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.461 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.11 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 75.51 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.429 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.1 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.52 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.04 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.5 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 74.45 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG21 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 75.31 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 72.22 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 75.11 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.13 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.466 HG21 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.12 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.483 ' HB ' HG12 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.1 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.24 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.05 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.44 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.23 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.54 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 62.54 112.321 172.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.486 ' HB3' ' HE3' ' A' ' 36' ' ' MET . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.32 111.905 179.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.35 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.542 HD21 ' HB2' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.3 111.692 -179.342 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 75.44 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.542 ' HB2' HD21 ' A' ' 77' ' ' ASN . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.31 111.265 172.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 72.03 110.644 -169.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 73.01 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.53 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.42 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.1 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.34 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.12 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 74.4 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.44 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.451 HG13 HG22 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 74.42 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 74.42 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 74.55 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.24 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 73.43 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 74.45 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' MET . . . . . 0.423 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 74.32 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.15 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 73.11 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 75.23 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -73.04 -54.87 7.46 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.462 HD13 ' HB3' ' A' ' 104' ' ' LYS . 40.3 tp -61.06 -27.84 68.64 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.615 0.766 . . . . 73.42 111.582 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.59 -40.43 65.66 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.47 1.108 . . . . 64.14 111.616 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -76.78 -38.66 53.63 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.53 0.732 . . . . 75.12 111.311 175.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HB3' HD13 ' A' ' 101' ' ' LEU . 35.6 ttmt -65.35 -38.39 89.95 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.082 0.953 . . . . 71.41 113.057 -175.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.3 m -70.86 -15.52 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.281 0.633 . . . . 72.21 112.443 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.3 t -74.91 -27.07 60.07 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.994 0.517 . . . . 74.12 110.859 172.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.88 58.94 6.34 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-N 116.152 -0.476 . . . . 75.33 113.704 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.3 m -68.0 92.22 0.37 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.255 0.622 . . . . 75.13 110.686 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 60.02 91.76 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.055 1.342 . . . . 75.31 111.982 -178.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.465 ' H ' HD22 ' A' ' 110' ' ' LEU . 1.9 pt? -62.5 105.4 0.62 Allowed 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 121.744 0.783 . . . . 70.51 111.296 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.2 142.02 81.65 Favored Pre-proline 0 CA--C 1.56 1.351 0 CA-C-N 115.791 -0.64 . . . . 71.22 111.976 -177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.57 -28.96 25.55 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.211 1.94 . . . . 72.41 112.431 172.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 . . . . . 0 CA--C 1.571 1.767 0 C-N-CA 124.225 1.01 . . . . 74.15 110.482 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.439 0.162 . . . . 75.22 111.138 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.26 75.85 1.72 Allowed Glycine 0 C--N 1.352 1.42 0 CA-C-N 116.297 -0.41 . . . . 74.0 112.736 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -74.97 -44.56 47.66 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.917 0.887 . . . . 75.22 111.353 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -129.81 146.85 51.54 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.03 0.932 . . . . 75.21 111.153 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -63.08 -25.27 68.29 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.028 0.931 . . . . 55.23 111.834 171.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.402 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 1.9 mp0 -52.09 -38.46 57.33 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.372 1.069 . . . . 72.1 112.649 176.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.15 -44.16 97.22 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 122.7 0.4 . . . . 74.44 111.247 173.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt -60.17 -38.58 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.704 0.802 . . . . 74.24 111.037 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 75.24 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.402 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 75.12 111.706 179.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.41 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 74.12 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.14 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.23 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 75.33 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.443 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.2 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.4 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.521 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.51 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 75.05 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 74.21 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 62.14 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.46 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.4 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.42 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.607 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.42 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.43 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.6 HG22 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 63.32 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.607 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 74.54 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.44 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.552 HG13 HD12 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.45 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 72.5 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.2 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.33 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 74.12 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.519 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 71.32 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.52 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.47 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.41 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 75.12 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.44 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.514 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.32 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.34 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.472 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 65.25 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.41 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.421 ' HB2' HG13 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 74.12 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.12 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 64.33 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.589 HG13 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 73.42 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.449 ' HD2' ' HE2' ' A' ' 69' ' ' MET . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.3 110.5 171.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.521 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.13 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 73.24 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.53 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 75.52 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.4 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.2 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 73.32 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.35 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.426 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 73.25 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.42 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 74.13 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 73.41 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 73.21 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' O ' HG21 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 64.33 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 72.12 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.4 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.52 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.24 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.589 ' HB ' HG13 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.13 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.449 ' HE2' ' HD2' ' A' ' 47' ' ' HIS . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 72.21 110.866 172.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.24 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.408 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 74.13 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.421 HG13 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.12 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.43 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 74.5 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.539 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.13 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.47 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 71.41 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.42 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.44 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.53 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.04 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.53 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 71.41 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 74.33 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.539 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 73.15 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.41 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.5 ' HA ' HD13 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.14 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.44 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.534 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.33 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.552 HD12 HG13 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 73.31 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.22 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.54 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 74.43 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.6 ' HG2' HG22 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.44 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 73.21 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.501 ' O ' HG22 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 73.35 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.426 HD21 HG11 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.45 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.34 111.73 170.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 73.22 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.501 HG22 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.1 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 74.54 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 75.31 112.835 -175.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.536 ' HA ' ' HE3' ' A' ' 103' ' ' LYS . 26.4 tp10 -64.28 -38.51 91.28 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 64.35 111.352 175.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -35.91 65.82 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-N 116.345 -0.389 . . . . 73.42 110.569 175.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.03 -41.69 97.33 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 111.979 0.362 . . . . 74.14 111.979 177.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.536 ' HE3' ' HA ' ' A' ' 100' ' ' GLU . 17.3 ptpt -70.61 -26.41 63.48 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 122.634 0.374 . . . . 75.24 110.911 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -66.14 -47.19 74.88 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.074 0.949 . . . . 74.15 111.407 175.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.58 -46.52 82.85 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 C-N-CA 123.388 0.675 . . . . 75.21 110.921 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.7 t -159.0 126.6 4.93 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.574 0.749 . . . . 75.31 110.167 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.93 -81.02 0.73 Allowed Glycine 0 CA--C 1.54 1.606 0 N-CA-C 113.91 0.324 . . . . 60.13 113.91 -175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 63.4 m -146.08 177.38 9.01 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.293 0.637 . . . . 62.12 112.48 -173.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -165.05 -50.48 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.182 0.993 . . . . 75.53 111.06 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.91 90.07 0.12 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.55 0.74 . . . . 74.41 112.621 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 27.8 m -105.4 139.01 19.74 Favored Pre-proline 0 N--CA 1.483 1.188 0 C-N-CA 124.25 1.02 . . . . 75.43 110.585 177.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.83 -36.65 30.7 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.594 2.196 . . . . 74.2 112.579 172.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 . . . . . 0 N--CA 1.488 1.44 0 C-N-CA 124.024 0.93 . . . . 75.22 111.021 -178.745 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.3 mtm . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.717 0.294 . . . . 64.3 110.493 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.17 147.31 9.07 Favored Glycine 0 CA--C 1.538 1.531 0 N-CA-C 114.622 0.609 . . . . 62.12 114.622 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.3 p -71.85 135.25 46.54 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.099 0.56 . . . . 52.43 110.539 176.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -74.33 163.05 28.26 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.312 0.856 . . . . 73.53 113.312 -171.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -66.16 -39.02 89.47 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.083 -0.962 . . . . 74.33 111.551 -175.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 42.4 mt-10 -65.48 -32.59 74.27 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.082 0.553 . . . . 72.31 112.24 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -60.48 -45.55 93.35 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.919 0.488 . . . . 75.0 110.787 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt -63.7 -40.3 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.165 0.986 . . . . 75.22 111.54 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 74.23 111.139 176.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.33 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 73.12 111.679 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.49 HG23 ' HZ2' ' A' ' 16' ' ' LYS . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.3 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.656 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 64.43 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.31 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 72.4 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.66 ' HE3' HD22 ' A' ' 101' ' ' LEU . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 74.0 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 61.21 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.442 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 75.23 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 73.05 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.13 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.45 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.459 HG13 HG21 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 75.15 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.34 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.45 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.13 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.13 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.567 ' HB3' ' HZ3' ' A' ' 27' ' ' LYS . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 75.22 111.684 173.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.11 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.505 HG13 HD12 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.31 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.43 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 71.03 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.23 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.24 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 71.2 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 74.22 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.558 ' HE1' ' HB3' ' A' ' 75' ' ' MET . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 72.53 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 73.33 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 75.1 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.468 ' HB3' HG11 ' A' ' 72' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.44 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.23 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.42 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.459 HG21 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 75.31 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.15 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 75.54 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 74.11 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.15 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.11 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.442 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.12 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.415 ' HB2' HD12 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 72.14 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 74.12 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 75.14 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 74.33 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.506 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 71.14 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 64.42 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.44 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 75.4 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.15 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.506 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.43 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.14 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.43 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.442 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.43 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 70.15 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.34 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 72.31 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 49' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 75.43 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.22 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.31 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 71.33 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 64.11 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.51 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.44 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.468 HG11 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 72.45 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 61.24 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 74.43 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.558 ' HB3' ' HE1' ' A' ' 36' ' ' MET . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.44 112.472 177.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 73.23 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.04 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.31 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.15 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 71.44 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 73.51 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 75.31 110.135 -170.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.412 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.44 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 64.32 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.11 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 75.24 110.965 172.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.505 HD12 HG13 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.13 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.52 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 74.43 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 73.4 110.438 177.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.468 ' HZ3' ' HB2' ' A' ' 91' ' ' LYS . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 73.31 111.725 171.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 73.32 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG21 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 73.44 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.35 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.44 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.11 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.21 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 74.32 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.22 113.533 -176.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.4 -34.19 58.83 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.42 110.185 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.66 HD22 ' HE3' ' A' ' 16' ' ' LYS . 46.1 tp -62.89 -31.37 72.4 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.2 1.0 . . . . 72.24 111.495 171.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.42 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 20.9 t70 -57.3 -37.84 73.06 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.831 0.852 . . . . 72.4 111.892 175.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.4 -36.23 68.67 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 123.719 0.807 . . . . 73.12 111.945 178.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HD3' HD13 ' A' ' 101' ' ' LEU . 50.3 mtpt -60.39 -47.0 87.97 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.817 0.847 . . . . 73.34 112.498 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.08 -18.05 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.165 0.586 . . . . 74.42 111.53 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.4 t -76.18 -33.38 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.667 0.787 . . . . 75.35 111.339 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.53 -36.65 4.26 Favored Glycine 0 C--N 1.35 1.309 0 CA-C-N 116.047 -0.524 . . . . 75.54 113.215 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.4 t -159.87 176.76 11.53 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.526 0.73 . . . . 71.53 110.87 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -85.43 103.14 14.05 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.56 0.744 . . . . 75.32 111.364 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.7 -39.89 30.23 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.317 -0.623 . . . . 75.11 109.317 169.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.3 m -116.97 143.41 31.54 Favored Pre-proline 0 CA--C 1.562 1.412 0 N-CA-C 108.688 -0.856 . . . . 65.44 108.688 159.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.87 -51.21 0.68 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.378 2.052 . . . . 73.24 113.295 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 . . . . . 0 CA--C 1.567 1.624 0 C-N-CA 123.71 0.804 . . . . 75.45 110.729 -169.227 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.558 0.694 . . . . 65.4 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.08 54.01 4.51 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 121.968 -0.458 . . . . 71.34 112.068 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m 52.82 -84.19 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.974 1.31 . . . . 71.03 112.163 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -148.09 -59.67 0.25 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.312 1.045 . . . . 73.3 110.037 175.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -72.32 -44.95 61.95 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.834 0.854 . . . . 75.31 112.107 -177.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.71 -30.54 71.63 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.725 0.41 . . . . 74.11 110.935 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -56.8 -55.37 35.21 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.882 0.873 . . . . 75.24 110.39 171.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm -59.01 -37.31 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.967 0.907 . . . . 74.22 112.014 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 74.22 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.31 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.33 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.33 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.4 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.45 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 65.0 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.52 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.14 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.11 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.04 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.34 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.448 HG13 HG21 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 75.04 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 70.15 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.655 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 74.15 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.458 ' O ' HG21 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 74.41 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.441 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 74.22 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.655 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 74.33 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.1 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.52 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 74.34 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.22 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 73.21 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 62.15 110.352 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 70.32 114.723 -171.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.35 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 72.34 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.651 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.23 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 72.11 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.43 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.52 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 74.04 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.35 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.51 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.448 HG21 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 74.11 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 74.35 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.423 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 74.11 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.606 HG12 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.33 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 73.4 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 73.03 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.423 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 74.54 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 74.05 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.35 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 73.33 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.4 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.34 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 74.21 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 72.34 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.54 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.13 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.42 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 71.21 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.413 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 64.12 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.04 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 73.13 111.992 175.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 55.15 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.23 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.45 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 64.31 110.511 175.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.606 ' HB ' HG12 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.32 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 74.23 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 62.52 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 75.3 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 73.42 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.53 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.411 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 74.22 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 72.25 112.152 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.651 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 71.23 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.23 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.41 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.652 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 75.13 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.652 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 64.13 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.31 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 74.53 109.52 -177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.402 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 72.32 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.506 ' HA ' HD13 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 62.23 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.45 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.624 HD11 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 75.21 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.506 HD13 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 74.14 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 72.22 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 75.2 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.22 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.04 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 75.43 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 75.3 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 74.11 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.473 ' N ' HD11 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.13 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 71.13 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.12 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.11 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.41 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.24 -46.83 78.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 72.14 110.633 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 tp -67.24 -39.12 86.15 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.396 0.678 . . . . 73.45 110.947 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -59.32 -37.92 78.99 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.949 0.9 . . . . 70.11 111.051 172.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -77.27 -19.88 55.88 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 71.15 111.459 179.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -79.31 -29.94 42.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.892 0.477 . . . . 73.53 111.699 172.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.5 t -89.6 -65.74 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.115 0.566 . . . . 71.55 111.006 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.1 t -69.54 -25.9 64.24 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.306 1.042 . . . . 61.34 112.786 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.32 74.1 2.11 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 114.624 0.61 . . . . 74.24 114.624 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t -126.46 89.39 3.0 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.96 0.904 . . . . 74.24 108.79 172.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -134.65 176.78 8.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.873 0.869 . . . . 75.32 110.982 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.2 63.06 1.99 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.664 1.185 . . . . 72.33 111.802 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 22.5 m -111.88 142.52 26.87 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 123.237 0.615 . . . . 72.15 112.142 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -74.16 154.14 46.67 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 123.24 2.626 . . . . 75.14 112.61 170.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.565 1.54 0 C-N-CA 123.164 0.586 . . . . 72.14 109.626 177.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.439 0.161 . . . . 75.1 111.072 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.91 99.53 0.18 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 113.815 0.286 . . . . 72.01 113.815 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.9 m -128.33 29.98 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.362 1.065 . . . . 72.42 109.943 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -62.46 -45.86 91.15 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.709 0.804 . . . . 74.22 111.175 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 75.7 mt-30 -58.78 -50.87 72.33 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.276 0.63 . . . . 72.43 111.078 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 40.8 tt0 -52.21 -50.73 61.36 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.766 0.826 . . . . 64.44 111.656 177.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -53.84 -50.49 66.09 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.154 0.982 . . . . 75.51 111.496 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt -63.77 -38.96 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.591 0.756 . . . . 75.41 111.863 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 5' ' ' GLN . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 73.41 111.885 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 74.41 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 72.41 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.434 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.52 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.599 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 63.3 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.41 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 74.12 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.599 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 73.12 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.32 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.52 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.22 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 75.44 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.12 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.521 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.02 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 74.03 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.22 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.436 ' O ' HG22 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.15 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.41 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 71.52 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 74.22 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.504 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 75.31 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.42 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 72.15 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.401 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 63.1 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.14 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 74.43 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 75.24 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.564 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.34 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 73.54 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.401 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.42 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.504 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.13 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.42 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.44 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.521 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 75.33 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.43 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.41 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 73.43 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 75.21 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.22 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.42 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.23 110.601 173.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 75.51 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 63.0 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 74.41 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.23 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.32 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 74.01 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.15 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 55.15 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.478 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.21 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.33 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.33 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 75.43 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 72.11 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.22 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 65.44 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.47 ' HA ' HD12 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.24 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.12 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.14 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.562 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.4 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 75.23 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 72.0 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.43 HD22 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 74.34 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 74.34 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 72.23 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.24 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 73.23 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.564 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.11 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 60.12 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 74.12 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.705 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 72.23 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.705 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.21 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.15 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.445 ' N ' HD11 ' A' ' 82' ' ' ILE . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 74.23 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.13 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.11 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.477 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.41 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.415 HD11 HG13 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 74.13 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.22 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.457 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.33 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.41 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 74.44 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.4 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.562 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 64.04 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 74.24 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 73.0 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.31 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.407 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 73.14 110.475 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.42 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -65.84 -45.86 80.65 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.03 109.798 171.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 97' ' ' VAL . 83.1 mt -59.03 -35.51 73.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.573 0.749 . . . . 63.51 111.12 174.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -44.27 92.63 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.669 0.787 . . . . 72.34 111.378 176.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . 0.44 ' HB3' ' HZ2' ' A' ' 103' ' ' LYS . 8.2 mtpm? -65.95 -34.44 78.13 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.004 0.521 . . . . 71.14 111.752 177.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -81.9 -36.99 27.52 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.148 0.579 . . . . 74.13 112.409 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.8 -22.28 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.736 -0.602 . . . . 75.31 110.445 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -70.64 -29.25 65.56 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.785 0.834 . . . . 72.33 111.762 172.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 176.15 80.27 0.05 OUTLIER Glycine 0 C--N 1.355 1.626 0 N-CA-C 114.212 0.445 . . . . 74.1 114.212 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 70.9 p -107.41 155.82 19.61 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.79 0.836 . . . . 75.54 111.002 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -147.33 125.96 12.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.554 0.742 . . . . 74.53 110.701 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.9 mt -96.56 119.39 34.96 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.427 0.691 . . . . 75.31 110.941 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.1 158.43 49.79 Favored Pre-proline 0 CA--C 1.565 1.544 0 C-N-CA 123.683 0.793 . . . . 73.1 110.728 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -61.57 -38.01 65.52 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 122.408 2.072 . . . . 62.12 113.491 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? . . . . . 0 N--CA 1.49 1.565 0 C-N-CA 123.35 0.66 . . . . 73.4 109.938 174.347 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.654 0.264 . . . . 75.11 111.442 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 60.2 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 73.52 111.388 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 73.01 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.21 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.3 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.1 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.21 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.14 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 54.53 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD11 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 50.42 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 63.54 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.43 111.702 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.52 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 65.44 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 52.42 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.34 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 51.5 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.13 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.34 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.549 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 73.53 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 72.3 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.15 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 72.11 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.41 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.451 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.34 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.52 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.02 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 63.01 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.33 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.549 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.44 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 64.13 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.42 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.489 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.11 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 61.31 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 72.33 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.23 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.662 HG11 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.12 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.41 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 71.01 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 72.14 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.4 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 54.25 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.427 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.24 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 73.22 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 65.12 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 53.21 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.11 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.427 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 64.44 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 73.3 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 70.41 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 64.42 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.44 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 63.32 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 HG13 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 71.23 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.43 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 72.24 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.662 ' HB ' HG11 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.13 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 62.54 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 55.53 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 71.34 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.32 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 54.41 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.42 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 74.3 111.89 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.611 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 55.41 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.34 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.12 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 74.31 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 62.04 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.41 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 34' ' ' GLU . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 72.15 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.34 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 72.11 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 62.01 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 63.52 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.43 HD13 HG12 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 44.34 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.22 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.04 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 72.53 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.34 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.13 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 64.01 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.32 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.52 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 61.42 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 71.31 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.11 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 70.32 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.708 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 . . . . . 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.02 110.134 175.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 112.119 0.414 . . . . 51.31 112.119 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 63.53 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.24 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.25 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 72.11 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.59 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 70.42 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.433 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 40.02 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.59 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 73.43 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 53.45 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 53.1 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.53 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.32 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.13 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.22 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.21 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.53 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 64.44 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 72.15 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 61.15 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 71.22 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 72.52 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.48 HG11 ' CE2' ' A' ' 39' ' ' TRP . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 73.53 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 63.15 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.44 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 61.34 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.32 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 43.43 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.654 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 72.15 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.601 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.42 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.22 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 74.33 111.57 171.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.54 HG23 HG13 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.35 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.439 ' HB2' HG11 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.32 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.11 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 54.14 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.709 HG11 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.54 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.03 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.3 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 62.43 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 71.43 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 71.12 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.14 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.1 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.01 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.12 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 50.4 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 41.43 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.425 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.14 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.42 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.12 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 55.52 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 73.33 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 43.45 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.45 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.51 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.14 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.709 ' HB ' HG11 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.41 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.31 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.23 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 72.35 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 72.42 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 72.43 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.582 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 54.43 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 73.21 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.04 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 40.43 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.793 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.11 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.793 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 71.03 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 71.23 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.606 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 53.42 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 44.24 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.32 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.4 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.436 HD23 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.43 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.601 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 71.23 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.02 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 64.42 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.402 HG13 HG23 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.2 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 71.24 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 51.02 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 73.24 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.33 111.754 174.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.53 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.33 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 61.55 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 63.23 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 72.51 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 112.214 0.45 . . . . 74.43 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.3 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.03 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.412 HG12 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.24 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 64.12 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.671 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 72.34 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.02 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 61.03 112.18 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.671 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.02 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.42 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.1 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 65.14 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 74.53 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.31 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 61.34 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 61.44 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.31 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 52.51 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.45 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 72.22 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.43 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.523 HG11 ' CE2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 61.33 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.31 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.13 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.52 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.15 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 55.12 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.34 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.619 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.33 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 71.24 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 52.22 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.523 ' CE2' HG11 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.21 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 42.3 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 73.2 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 72.4 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.44 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 60.23 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.601 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.01 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.1 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 62.12 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 64.43 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.24 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.11 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.412 HG23 HG12 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 53.13 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.509 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.43 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 64.24 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 65.53 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.53 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 63.44 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.509 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.54 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.24 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 62.13 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.51 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.2 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 72.25 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 64.42 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 HG13 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 73.32 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.55 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 35.11 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.601 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 63.04 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 51.0 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 65.02 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 72.42 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 61.24 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 62.02 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.568 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 64.31 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.457 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 63.24 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.619 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 53.25 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.23 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 63.54 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.788 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.788 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.24 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 54.53 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.457 HG13 ' HG2' ' A' ' 75' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.2 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 73.24 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 70.04 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.44 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.45 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 60.43 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.54 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 73.11 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.21 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 72.24 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 62.24 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 71.41 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.45 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.11 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 61.43 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.14 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.14 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 70.14 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 53.33 110.116 -174.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' SD ' ' A' ' 56' ' ' MET . 90.8 mt . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 120.351 0.119 . . . . 64.34 111.114 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.31 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.03 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.43 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.41 110.63 170.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 71.13 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.13 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.53 112.081 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.41 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.34 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 60.45 111.064 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.02 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 72.45 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 74.24 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 71.05 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 54.2 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.33 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.469 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 64.54 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.653 HG21 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.42 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.32 111.474 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.44 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.556 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 63.34 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 54.41 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 64.3 111.35 164.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.11 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.13 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.2 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 64.2 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.32 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.2 111.797 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.1 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.556 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.52 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.31 109.726 170.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.05 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 54.41 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.35 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.51 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.31 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG13 HD12 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 70.22 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 62.5 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 62.51 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.12 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.43 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.05 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.11 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.43 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 72.44 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.466 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.22 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.34 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 70.43 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.12 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.14 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.31 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 70.41 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 62.34 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 60.3 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.23 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.22 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 71.42 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.05 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 43.21 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 67' ' ' THR . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 72.33 110.783 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.15 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 65.43 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.4 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.547 ' HE2' HG23 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 60.04 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.553 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 72.34 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 73.01 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 71.1 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.77 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 51.34 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.77 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.13 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 70.21 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.547 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 62.04 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.495 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.3 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 61.34 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.401 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 62.3 109.651 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 70.11 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 53.41 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 63.22 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.653 ' HG2' HG21 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 60.05 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 73.53 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.11 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.4 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.51 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 71.03 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.13 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 71.02 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.12 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 71.52 111.398 -179.314 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.721 -0.103 . . . . 63.12 110.721 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 51.32 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 70.41 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 52.22 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 62.15 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.34 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.13 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 61.24 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.44 111.341 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.4 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.45 HD21 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 65.2 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.575 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.43 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 65.22 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.22 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.412 HG12 HD22 ' A' ' 94' ' ' LEU . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 64.21 111.303 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 72.43 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.43 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.5 ' O ' HG23 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 62.03 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.531 HG21 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 73.32 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.44 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 65.42 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.53 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 73.3 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.35 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 72.21 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.31 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.43 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.1 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 71.43 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.404 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.4 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 43.42 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.53 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 72.53 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.44 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.49 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 72.21 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.34 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 74.34 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.34 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 53.55 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.501 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 65.11 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.34 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' HD21 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.41 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 55.43 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 73.32 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.23 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.13 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.464 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 62.14 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.02 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 63.13 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.43 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 52.01 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.464 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.42 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 61.01 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 63.45 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.419 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.51 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.12 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 65.54 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 74.23 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.43 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.41 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 73.35 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.41 ' HB ' HG11 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.23 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 64.04 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.42 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.402 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.33 111.192 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 52.1 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.04 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.46 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 72.22 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.6 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.2 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.404 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.21 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 73.43 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.13 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 73.11 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.34 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.44 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 63.14 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 52.31 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 52.21 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.14 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.6 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 54.51 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.42 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.44 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 45.41 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.52 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.531 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 71.23 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 73.22 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 52.44 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.45 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.3 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 71.44 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 53.13 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 71.22 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.42 110.404 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.115 0.483 . . . . 62.51 111.495 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.426 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.23 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 61.04 110.854 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.426 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 42.24 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 65.54 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 64.11 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.32 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 73.34 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 71.51 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.24 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 54.33 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 65.53 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.13 111.94 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.568 HG13 HG23 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 64.12 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.13 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.23 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.23 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 91' ' ' LYS . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 62.35 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.41 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.44 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 64.12 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 60.43 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 63.54 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.34 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 64.5 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 65.32 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.01 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.735 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 63.32 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 64.4 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.44 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.542 ' HB3' HG13 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 2.6 t-20 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.12 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.45 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.568 HG23 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 65.0 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.33 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.2 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 72.43 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.572 HG13 HD12 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 51.24 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 72.12 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.426 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 63.5 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.0 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 55.54 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 54.51 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.13 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.559 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.31 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.21 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 51.21 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 72.01 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.14 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.559 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.34 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 61.43 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.44 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.433 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 55.45 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 60.41 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' HG23 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 63.55 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 73.23 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 65.24 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.11 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 54.22 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.42 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 61.34 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.3 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.542 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.35 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 62.3 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.742 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 51.01 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 35.42 112.083 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.735 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 74.12 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.453 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.33 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.34 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.707 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.41 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.742 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 62.23 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.51 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 ' N ' ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 73.25 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.01 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.444 ' HA ' HD12 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.45 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 70.33 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 70.51 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.51 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 65.23 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 63.34 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.15 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.668 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 63.01 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 72.33 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 74.12 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 65.03 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.486 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 71.33 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.22 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.41 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 61.11 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 72.54 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 . . . . . 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.34 111.265 173.919 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 mm . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.187 0.44 . . . . 73.24 112.187 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.35 111.578 173.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.31 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 70.11 112.158 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.43 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.22 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 54.25 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.01 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.22 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.54 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.41 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 94' ' ' LEU . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.54 111.57 174.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.22 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 53.43 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.42 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.53 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.41 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.43 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.45 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.44 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.24 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.53 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 62.31 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 61.02 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.51 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.11 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.42 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.44 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.474 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 63.21 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.54 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.564 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 63.25 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 51.31 110.041 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 64.22 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.446 HG23 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 65.54 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.43 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 72.42 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.15 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 64.25 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 74.43 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.54 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.42 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 73.42 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.55 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 62.41 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 72.12 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.41 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.14 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 60.35 111.991 172.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.467 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.02 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 62.22 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 63.04 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 54.31 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 53.11 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.24 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.41 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 64.35 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.44 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 41.44 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.5 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 65.52 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 71.11 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 71.11 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.42 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 65.31 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.13 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.677 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 71.45 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 51.32 111.871 176.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.474 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.21 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.2 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 62.0 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.736 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.3 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.736 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.1 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.52 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.564 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 63.21 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 55.31 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.34 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.521 HD12 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.23 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.23 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 73.45 110.819 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.521 ' HD2' HD12 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 53.13 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 64.34 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.05 111.794 173.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 71.12 112.699 -176.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 70.34 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.424 HD11 HG23 ' A' ' 19' ' ' ILE . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 44.14 110.651 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.13 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 72.41 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.54 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 65.41 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.04 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 61.31 109.729 174.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm . . . . . 0 CA--C 1.559 1.294 0 CA-C-O 120.972 0.415 . . . . 65.44 111.581 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.01 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 71.4 111.158 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.02 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 73.22 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.32 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 52.54 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 55.21 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.23 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 62.43 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 52.21 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.453 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.31 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 60.34 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.42 111.85 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.449 HG13 HG23 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.44 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.24 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.31 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 62.13 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 62.14 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 72.02 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.42 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.45 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.11 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 61.0 111.538 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.33 110.588 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 73.53 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.4 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.24 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.22 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.02 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.532 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.15 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.01 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.723 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.1 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.449 HG23 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.42 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.12 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.723 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 71.13 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 73.3 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.573 HG11 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.02 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.0 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.464 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 44.54 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 54.23 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 70.15 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.01 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.44 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.497 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 71.13 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.03 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 54.4 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.31 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.32 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.497 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.43 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.31 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.02 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.14 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 55.1 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 67' ' ' THR . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.22 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 62.52 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.13 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 72.34 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.599 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 64.32 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.32 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.34 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 72.42 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.25 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.44 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.42 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 60.2 112.519 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.739 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.15 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 71.04 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.42 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 62.15 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.466 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 72.23 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.23 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.03 108.767 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.14 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 45.3 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.23 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.33 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.14 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.53 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.44 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.429 HG13 HG23 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 72.34 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 65.11 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 60.53 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.599 ' HB3' HD11 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 73.34 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.453 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 64.24 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 54.03 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.31 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.15 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 72.1 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.33 110.212 -177.286 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.499 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm . . . . . 0 CA--C 1.557 1.234 0 CA-C-O 120.968 0.413 . . . . 74.42 110.797 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 62.45 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.35 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.401 HG12 HG23 ' A' ' 52' ' ' ILE . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.02 111.794 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 53.14 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.32 113.413 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.33 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.33 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.44 111.456 -173.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.12 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.11 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.13 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.21 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.32 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.53 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.43 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.54 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.22 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.478 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.03 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 63.23 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.41 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.559 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 64.21 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.35 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 72.13 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.52 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 71.52 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HA ' HD13 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.31 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 54.25 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.04 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.01 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 71.53 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.559 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.41 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 65.1 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 63.51 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.31 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.51 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 71.14 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.12 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.635 HG11 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.42 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 73.43 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.31 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.15 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 70.13 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.54 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.401 HG23 HG12 ' A' ' 11' ' ' VAL . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.1 110.363 175.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.22 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.44 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.499 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 71.44 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.42 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.53 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 63.12 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.43 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 71.22 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.32 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' O ' HG23 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 71.52 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.633 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 73.52 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.401 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 46.1 t60 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 70.53 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.42 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG11 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.2 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 52.33 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.41 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.11 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 73.1 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.13 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 73.12 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 72.14 111.343 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.32 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 53.11 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.53 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.694 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.24 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.694 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.54 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 73.54 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.587 HG22 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 73.53 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 65.2 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.587 ' H ' HG22 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 70.52 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.44 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.13 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 72.03 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 63.41 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 64.55 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.02 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.478 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.23 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.53 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 73.4 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 73.2 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.14 109.279 170.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 64.24 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 64.34 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 61.32 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.2 111.821 -178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.41 110.549 178.918 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 120.657 0.265 . . . . 62.04 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.51 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 64.41 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.4 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.51 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.52 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.22 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.42 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 71.11 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 54.34 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 74.21 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.34 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.44 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.21 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.13 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 71.33 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.498 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 62.44 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.43 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 71.13 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.14 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.522 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 60.45 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.14 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 70.15 111.509 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 70.45 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.32 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.02 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 70.24 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.54 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.24 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.23 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 54.24 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 22' ' ' VAL . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 64.31 111.111 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 62.35 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' HIS . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.01 112.271 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 73.1 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.575 HG13 HD12 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 71.13 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 44' ' ' ARG . 72.1 t60 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.11 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 71.31 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 61.02 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.3 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.52 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 62.05 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 60.21 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.1 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.03 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 74.41 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.538 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.33 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.33 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 65.32 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.24 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.04 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.32 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.575 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.55 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.14 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 63.1 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 73.02 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.01 110.402 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.12 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 73.24 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 55.13 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 72.51 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.23 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.406 ' HE2' HG23 ' A' ' 82' ' ' ILE . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 64.41 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 73.14 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.43 111.701 178.239 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.53 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.519 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.34 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 74.15 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 71.51 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 82' ' ' ILE . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.21 109.821 -175.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 70.0 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.452 ' HA ' HD12 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.52 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 71.23 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.51 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.35 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.05 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 72.42 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.11 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.33 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.42 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 63.54 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.23 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 65.35 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.51 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 61.41 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.51 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 71.31 109.568 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 112.463 0.542 . . . . 64.54 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.3 111.394 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 51.42 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 70.25 112.87 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 53.51 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 70.12 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.21 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.481 HD21 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.24 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.14 111.196 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.22 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.473 HD11 HD22 ' A' ' 45' ' ' LEU . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.13 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.509 HG23 HD13 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 72.33 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.34 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.23 112.075 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 55.24 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.04 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 53.13 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 63.4 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.587 HG21 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.05 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.4 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 74.12 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.462 HG11 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.52 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.1 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 63.2 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.4 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.11 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 70.55 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.02 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.52 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.51 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 62.04 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.462 ' CE2' HG11 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.43 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.01 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 55.31 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 53.22 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 72.11 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 61.33 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD22 HD11 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.31 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.524 HG11 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.41 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 60.41 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.41 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.14 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 64.04 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 42.2 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 54.31 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.34 112.655 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.42 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.43 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.13 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 52.1 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.418 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.04 111.096 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.23 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.34 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 64.21 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 51.01 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 74.31 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.14 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.4 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 71.42 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.53 HD12 ' H ' ' A' ' 68' ' ' ILE . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 64.34 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 63.11 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 63.43 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 61.31 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.41 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 64.51 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.41 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.543 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 55.12 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.647 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 61.41 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 62.12 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.4 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.451 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.31 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.451 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.14 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.44 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.54 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.45 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.624 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 54.44 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.441 ' H ' HG22 ' A' ' 82' ' ' ILE . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.13 113.265 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 51.53 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.624 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.53 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.03 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.42 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 64.05 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.424 HG11 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.12 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.587 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 72.22 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 52.22 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 50.21 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.509 HD13 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 61.32 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 71.13 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.481 HG12 HD21 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.43 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.12 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 54.23 112.39 -173.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.72 0.295 . . . . 65.45 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 51.25 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.42 112.569 -178.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.35 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 64.24 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 72.42 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.2 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.21 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.45 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.41 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.471 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 72.31 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HA ' HD21 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.45 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 65.23 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 70.44 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.407 HG13 HG23 ' A' ' 42' ' ' ILE . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 72.3 111.924 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 74.24 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.22 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.4 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.41 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.11 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 72.43 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 73.3 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.04 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.01 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.439 ' HA ' HG12 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 74.55 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.21 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.32 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.54 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 64.21 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.03 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 29' ' ' VAL . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.35 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 73.41 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.43 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.407 HG23 HG13 ' A' ' 22' ' ' VAL . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 71.1 112.024 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.1 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 64.41 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 71.04 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD12 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 62.31 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 43.31 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.471 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.21 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.15 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 71.44 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 74.53 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 71.44 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.537 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 61.51 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 65.0 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.03 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.21 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 15.51 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.537 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.14 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.52 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.23 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 73.03 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.24 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.45 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 54.53 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.565 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.44 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 71.15 110.952 177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 54.25 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.435 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.43 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 60.23 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.33 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.34 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 73.12 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.03 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.22 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 65.24 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.593 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.22 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.31 112.233 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 63.32 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.735 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 62.32 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.735 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 71.42 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 71.21 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 82' ' ' ILE . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 62.32 109.432 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.52 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 73.22 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.31 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.444 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 70.15 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.41 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 53.11 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.42 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 72.41 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.31 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' HG23 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 64.32 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.13 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.23 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.42 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.11 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 71.42 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.44 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 65.41 110.917 178.518 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.556 1.178 0 N-CA-C 111.639 0.237 . . . . 73.41 111.639 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 65.13 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 61.53 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.477 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 72.05 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.22 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.43 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 71.25 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.614 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 72.02 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.614 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 74.42 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.12 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HA ' HD12 ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 72.44 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.12 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 64.33 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 70.0 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.457 HG13 HG23 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.43 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.12 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.23 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 62.24 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.594 HG21 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.44 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 63.42 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.32 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.606 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 51.11 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.32 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 71.1 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.4 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 73.03 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.41 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.44 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.55 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.03 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.606 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.52 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.43 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.41 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.515 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 72.03 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.42 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 64.11 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.33 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.54 HG13 HD12 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 63.14 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 73.43 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.34 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 71.43 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.44 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 71.34 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 73.22 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 64.5 111.885 -178.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.53 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.22 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.31 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.24 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.412 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 72.44 111.46 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.44 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.1 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.31 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 51.43 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 70.55 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.13 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.54 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.14 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.33 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 63.22 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.468 HG21 HG21 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 32.32 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 40.15 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.34 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 60.52 110.762 -179.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.01 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 63.15 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.693 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 73.54 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.698 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 52.31 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.478 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.24 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 44.12 110.699 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 64.02 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 62.14 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.693 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.4 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 72.24 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.698 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.21 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.3 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.24 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.52 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.42 ' HG ' HD21 ' A' ' 71' ' ' LEU . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.454 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 51.13 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.53 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.44 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.422 HG13 HG23 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.12 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.594 ' HG2' HG21 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 72.04 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.11 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.53 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 73.53 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 65.45 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.01 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 55.13 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.45 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.24 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 . . . . . 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 55.22 111.702 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.557 HG23 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.933 0.397 . . . . 65.24 111.052 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 61.43 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 70.51 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.555 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.22 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.42 111.189 165.454 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.24 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 74.41 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 74.54 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.24 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.34 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.33 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.438 HG23 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.1 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 61.24 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 71.43 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.21 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 62.25 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.55 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.2 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.01 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.05 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.23 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.578 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.54 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 42.21 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.51 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 70.24 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 71.32 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HA ' HD12 ' A' ' 82' ' ' ILE . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.33 112.443 -173.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.11 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.02 111.984 -173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 53.02 111.377 176.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 73.5 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.578 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.33 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.21 110.222 170.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.24 111.132 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.417 HG23 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 71.25 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.13 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.45 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.44 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.612 HG11 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.32 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 65.23 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.12 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 64.3 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.517 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 73.25 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.32 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' HG22 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.31 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 52.44 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 64.44 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 62.21 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.557 ' SD ' HG23 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 63.32 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 63.04 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.22 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 54.33 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.23 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.66 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 63.23 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.02 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.32 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 60.34 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 50.11 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 62.12 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.02 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.612 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 44.33 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.517 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.55 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.34 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 63.31 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 41.33 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 72.3 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 63.2 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.503 ' HB3' HD11 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 64.33 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 64.2 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 54.41 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.23 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.31 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 45.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 72.32 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.12 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 61.53 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.523 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 63.13 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.2 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.2 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 72.23 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 62.22 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 52.41 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 63.21 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.427 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.41 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.43 ' CB ' HD11 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.33 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HG ' HG23 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.23 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.03 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.51 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.14 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.21 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.427 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.54 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.66 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.24 110.874 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.052 0.453 . . . . 42.35 110.933 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 73.24 111.328 171.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 62.3 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 44.12 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 61.34 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.33 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.02 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.453 HD21 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.11 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 65.21 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.52 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 72.04 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.52 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.11 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.21 111.999 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.03 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.12 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.756 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.43 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.41 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.48 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.14 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.756 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.53 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.53 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.2 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 63.11 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 70.44 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.14 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 53.35 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 74.43 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.52 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.45 113.467 -170.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 64.13 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.14 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 63.21 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 64.11 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.53 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.43 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.04 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.3 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 71.54 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.02 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.22 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.525 ' HB ' HD21 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.42 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.12 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.42 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 70.34 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 70.02 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.31 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.44 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 71.3 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 64.13 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.11 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.43 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.11 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.52 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 64.15 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 62.25 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.51 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.42 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 71.42 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 74.33 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 60.03 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.45 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.412 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 73.14 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 50.42 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.32 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 72.24 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.04 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 62.1 111.747 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 51.51 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 52.31 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 61.02 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.602 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 64.54 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.602 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 64.45 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 64.22 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.475 HG21 ' HE1' ' A' ' 39' ' ' TRP . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 61.43 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.13 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 33.03 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.23 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.33 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.476 HD13 HG12 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.24 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.42 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.03 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.33 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.41 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 65.51 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.34 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.42 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 70.45 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.453 HG12 HD21 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.41 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 63.04 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.13 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.32 111.229 176.41 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.003 -0.046 . . . . 75.45 111.013 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.42 111.557 176.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.34 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 52.11 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.23 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 55.2 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.11 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 53.24 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 74.53 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.2 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.31 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' HD11 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 64.52 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 74.44 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.43 112.088 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.32 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.51 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 63.03 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.53 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.01 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.32 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 71.31 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.486 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.12 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.22 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 52.32 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 72.32 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.44 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.02 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.01 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.2 112.514 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.42 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.14 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.486 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.34 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.04 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.426 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 71.21 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 72.51 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 60.23 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 63.14 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.13 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.24 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 52.23 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.466 ' HB ' HD21 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.33 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.51 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.15 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 72.31 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 53.24 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.451 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 64.24 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 53.43 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.55 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.11 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 73.11 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.451 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.1 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.52 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.04 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.41 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 70.4 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 73.04 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 62.04 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 53.42 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.13 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.12 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.1 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.24 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.05 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.44 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.23 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.54 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG13 ' A' ' 80' ' ' ILE . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 53.54 112.321 172.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.32 111.905 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.12 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.3 111.692 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 74.44 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.31 111.265 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 74' ' ' LYS . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 71.13 110.644 -169.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 61.22 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.53 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.42 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.1 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.34 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.12 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 65.04 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.44 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.448 HG13 HG23 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 72.24 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 73.55 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 54.32 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.24 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 53.4 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 55.11 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' MET . . . . . 0.463 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 62.04 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.15 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 62.03 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 71.44 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 . . . . . 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.688 0.28 . . . . 74.13 111.037 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 73.31 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 60.31 111.706 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.41 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 53.42 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.14 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.23 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 61.13 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.2 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.4 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.51 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 72.4 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 65.3 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 61.32 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.4 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.42 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.42 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.43 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.622 HG21 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 43.4 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 65.34 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.44 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.557 HG12 HD13 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.45 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 65.23 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.2 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.33 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 73.51 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.535 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 64.25 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.52 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.41 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 62.33 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.44 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.32 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.34 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 64.33 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.458 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.24 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.419 ' HB2' HG11 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 60.11 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.12 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 53.54 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.57 HG11 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 72.01 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.04 110.5 171.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.561 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.13 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 65.41 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.53 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 61.11 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.444 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.4 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.2 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 34.14 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.2 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.444 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 71.11 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.42 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 61.15 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 32.13 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 72.13 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 62.15 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 70.32 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.557 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.32 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.52 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.24 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.57 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.13 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 54.1 110.866 172.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.24 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.423 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 44.15 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.12 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.43 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 71.01 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.549 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.13 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 70.44 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.42 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.44 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.04 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.547 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 52.11 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 73.03 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.549 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 71.33 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.41 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.515 ' HA ' HD12 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.14 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.44 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.54 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.33 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.557 HD13 HG12 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 72.53 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.11 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.54 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 70.51 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.622 ' HG2' HG21 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.44 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 72.43 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.511 ' O ' HG23 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 52.44 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD22 HG12 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.45 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.406 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.34 111.73 170.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 70.14 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.1 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 61.33 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.406 ' NH2' ' HB3' ' A' ' 95' ' ' ASP . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 73.33 112.835 -175.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 60.34 111.352 175.08 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.778 0.323 . . . . 75.22 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 41.02 111.139 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.33 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 62.35 111.679 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.3 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.674 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 53.32 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.31 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 65.21 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 73.34 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 55.45 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 73.13 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 64.4 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.13 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.45 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.465 HG13 HG23 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 71.32 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.34 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.45 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.13 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.13 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 52.24 111.684 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.11 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 HD13 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.31 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.43 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 63.23 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.23 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.24 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 53.22 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 73.14 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.435 ' HE3' HD11 ' A' ' 82' ' ' ILE . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 62.14 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 54.44 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 73.33 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.474 ' CE2' HG11 ' A' ' 29' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.44 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.23 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.42 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.465 HG23 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 74.15 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.15 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 70.23 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 73.24 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.15 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.11 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.12 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.422 ' HB2' HD13 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 71.14 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 73.34 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 54.12 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 73.41 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 52.54 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 63.32 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.44 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 63.12 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.15 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.43 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.14 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.43 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.437 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.43 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 64.42 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.34 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 62.34 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 73.41 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.22 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.31 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 63.5 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 61.25 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.51 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.44 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 71.44 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 53.14 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 63.42 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.44 112.472 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 63.45 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.04 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.31 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.15 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 62.42 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 65.22 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 36' ' ' MET . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 72.0 110.135 -170.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.44 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 63.55 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.11 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 90' ' ' VAL . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 71.42 110.965 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.496 HD13 HG12 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.13 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.44 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 73.05 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 86' ' ' LEU . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 61.54 110.438 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 72.2 111.725 171.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 72.01 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 71.42 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.35 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.44 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.11 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.11 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 73.15 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.22 113.533 -176.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.42 110.185 176.333 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 112.014 0.375 . . . . 74.11 112.014 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 71.44 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.31 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.33 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.1 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.4 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.45 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 51.23 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.52 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.14 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.11 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.04 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.34 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 73.54 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.482 HG13 HG23 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 62.45 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 62.32 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 62.33 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.47 ' O ' HG23 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 72.43 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 73.33 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 70.44 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.1 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.552 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 63.51 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.22 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 62.25 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 61.41 110.352 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 29' ' ' VAL . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 54.22 114.723 -171.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.35 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 64.42 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.652 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.23 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 71.12 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.43 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.552 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 73.02 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.35 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.51 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.482 HG23 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 64.35 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 60.0 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 54.44 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.607 HG11 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.33 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 72.13 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 72.12 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 72.33 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 50.14 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.35 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 72.31 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.532 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.4 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.34 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 72.44 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 60.14 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.54 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.532 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.13 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.42 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 54.34 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.415 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 62.31 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.04 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 67' ' ' THR . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 64.21 111.992 175.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 54.25 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.23 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.45 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 63' ' ' LYS . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 62.12 110.511 175.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.607 ' HB ' HG11 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.32 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.411 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 73.05 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 52.41 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 74.42 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 63.21 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.53 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 64.3 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.422 ' HE2' HG23 ' A' ' 82' ' ' ILE . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 61.12 112.152 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.652 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 61.31 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.23 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.41 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.66 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 63.13 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 62.34 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.31 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 55.42 109.52 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.404 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 63.23 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 42.52 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.45 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.639 HD12 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 64.3 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.52 HD12 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 61.11 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 54.21 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.639 ' HD2' HD12 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 74.03 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.22 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.04 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 74.04 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 72.33 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 71.34 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.485 ' N ' HD12 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.13 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 43.12 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.12 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.11 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.41 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 61.43 110.633 176.001 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 111.863 0.32 . . . . 73.22 111.863 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 70.22 111.885 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 71.51 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 62.45 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.52 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.601 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 54.21 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.41 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 55.44 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 54.25 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.32 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.52 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.22 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 71.13 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.12 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.52 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.02 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 54.53 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.22 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.15 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.41 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 65.51 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 64.42 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 62.22 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.42 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 70.54 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.402 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 60.33 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.14 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 71.45 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 74.11 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.574 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.34 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 64.44 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.42 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.13 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.42 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.44 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.52 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 74.1 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.43 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.31 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 64.11 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 72.32 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.22 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.42 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.416 ' O ' HG22 ' A' ' 53' ' ' THR . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.23 110.601 173.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 74.41 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 61.04 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 72.21 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.23 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.32 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 53.25 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.15 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 41.52 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.21 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.33 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.33 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 64.23 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 60.15 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.22 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 51.41 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.24 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.12 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.14 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.4 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 64.25 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 71.12 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.452 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 71.21 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 70.01 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 54.41 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.24 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 71.3 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.11 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 35.42 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 34.01 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.713 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 71.24 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.713 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.21 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.15 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 ' HE1' ' A' ' 36' ' ' MET . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.491 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 62.33 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.11 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.11 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.3 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.427 HD13 HG12 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 70.33 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.22 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.476 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.33 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.41 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 70.52 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.4 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 62.15 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 65.35 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 64.21 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.31 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 64.42 110.475 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.42 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.03 109.798 171.729 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.554 0.216 . . . . 71.1 110.915 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.49 64.5 4.29 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 116.515 -0.311 . . . . 43.25 112.804 177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.3 p -151.99 150.09 29.61 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.719 0.808 . . . . 74.34 111.208 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 -83.26 106.72 15.27 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.099 0.56 . . . . 72.14 110.69 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -64.73 -30.6 71.62 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.642 0.777 . . . . 75.34 111.258 177.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -55.9 -34.76 65.85 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.949 0.9 . . . . 64.33 112.153 175.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -64.95 -50.65 65.58 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.919 0.488 . . . . 74.5 110.575 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -58.24 -41.18 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.779 0.831 . . . . 75.11 111.442 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 60.2 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 73.52 111.388 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 73.01 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.21 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.3 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.1 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.21 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.14 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.458 ' HA ' HD12 ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 54.53 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD11 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 50.42 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 63.54 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.43 111.702 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.52 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 65.44 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 52.42 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.34 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 51.5 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.13 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.34 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.549 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 73.53 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 72.3 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.15 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 72.11 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.41 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.451 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.34 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.52 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.02 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 63.01 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.33 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.549 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.44 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 64.13 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.42 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.489 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.11 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 61.31 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 72.33 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.23 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.662 HG11 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.12 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.41 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 71.01 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 72.14 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.4 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 54.25 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.427 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.24 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 73.22 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 65.12 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 53.21 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.11 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.427 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 64.44 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 73.3 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 70.41 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 64.42 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.44 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 63.32 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 HG13 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 71.23 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.43 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 72.24 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.662 ' HB ' HG11 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.13 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 62.54 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 55.53 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 71.34 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.32 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 54.41 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.42 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 74.3 111.89 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.611 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 55.41 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.44 HD22 ' N ' ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.34 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.12 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 74.31 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 62.04 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.41 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 34' ' ' GLU . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 72.15 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.34 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 72.11 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 62.01 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 63.52 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.43 HD13 HG12 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 44.34 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.22 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.04 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 72.53 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.34 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.13 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 64.01 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.32 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.52 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 61.42 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 71.31 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.11 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 70.32 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.708 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 -77.86 -34.41 51.76 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.02 110.134 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.0 tt -65.85 -27.2 68.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.941 0.896 . . . . 71.44 110.957 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -32.1 69.88 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.847 -0.533 . . . . 72.14 111.589 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -76.41 -15.91 59.83 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.313 0.645 . . . . 72.44 112.507 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -57.64 -32.99 67.81 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.184 0.994 . . . . 72.21 113.541 -172.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.7 m -69.79 -33.14 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.429 0.529 . . . . 72.33 112.429 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -79.46 -65.49 0.99 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.105 0.562 . . . . 52.13 110.767 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.82 -2.03 84.55 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 114.336 0.494 . . . . 72.45 114.336 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 57.0 p -82.14 81.33 8.1 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.28 0.632 . . . . 73.25 110.679 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -84.14 69.47 10.39 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.38 0.672 . . . . 62.43 111.477 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.2 mt 71.93 -33.01 0.26 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.111 1.764 . . . . 74.21 114.947 175.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -63.66 137.83 97.2 Favored Pre-proline 0 CA--C 1.566 1.595 0 CA-C-N 118.652 0.66 . . . . 70.14 111.581 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_exo -54.31 -36.53 87.14 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 123.524 2.816 . . . . 71.21 114.503 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.559 1.305 0 C-N-CA 123.471 0.709 . . . . 72.34 109.251 -176.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 120.641 0.258 . . . . 53.34 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.1 104.94 2.88 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 111.72 -0.552 . . . . 74.44 111.72 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -67.3 110.36 3.5 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.655 0.782 . . . . 74.11 112.056 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -73.57 108.44 6.42 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.016 0.526 . . . . 53.51 111.046 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -61.23 -28.6 69.28 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.525 1.13 . . . . 73.23 112.113 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -59.11 -46.8 87.39 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.016 0.926 . . . . 74.4 110.757 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.52 -47.32 79.27 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 116.103 -0.499 . . . . 74.34 110.926 175.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm -58.35 -46.68 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.654 0.781 . . . . 51.31 112.119 -174.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 63.53 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.24 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.25 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 72.11 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.59 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 70.42 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.433 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 40.02 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.59 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 73.43 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 53.45 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 53.1 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.53 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.32 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.13 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.22 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.21 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.53 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 64.44 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 72.15 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 61.15 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 71.22 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 72.52 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.48 HG11 ' CE2' ' A' ' 39' ' ' TRP . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 73.53 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 63.15 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.44 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 61.34 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.32 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 43.43 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.654 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 72.15 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.601 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.42 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.22 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 74.33 111.57 171.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.54 HG23 HG13 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.35 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.439 ' HB2' HG11 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.32 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.11 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 54.14 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.709 HG11 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.54 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.03 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.3 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 62.43 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 71.43 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 71.12 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.14 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.1 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.01 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.12 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 50.4 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 41.43 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.425 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.14 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.42 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.12 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 55.52 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 73.33 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 43.45 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.45 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.51 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.14 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.709 ' HB ' HG11 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.41 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.31 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.23 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 72.35 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 72.42 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 72.43 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.582 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 54.43 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 73.21 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.04 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 40.43 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.793 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.11 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.793 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 71.03 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 71.23 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.606 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 53.42 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 44.24 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.32 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.4 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.436 HD23 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.43 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.601 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 71.23 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.02 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 64.42 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.402 HG13 HG23 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.2 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 71.24 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 51.02 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 73.24 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.33 111.754 174.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.53 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.33 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 61.55 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 63.23 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 72.51 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -76.27 -29.06 57.3 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 104' ' ' LYS . 95.3 mt -71.97 -29.9 64.73 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.018 0.927 . . . . 74.54 111.7 174.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -57.42 -48.35 79.36 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.494 0.718 . . . . 74.3 110.226 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -63.78 -40.97 97.95 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.804 -1.089 . . . . 71.14 110.811 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 101' ' ' LEU . 25.9 mmtt -57.31 -36.0 70.54 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.442 1.097 . . . . 71.13 112.667 177.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 101' ' ' LEU . 65.4 t -73.25 -50.92 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 122.38 0.272 . . . . 74.44 110.827 175.072 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 58.0 m 67.04 118.73 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.979 1.312 . . . . 74.21 111.503 -172.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.03 39.12 8.15 Favored Glycine 0 N--CA 1.478 1.471 0 CA-C-N 116.436 -0.347 . . . . 53.45 112.588 -174.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.3 m -96.81 22.5 8.15 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.905 0.882 . . . . 75.33 111.676 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -59.58 108.4 0.72 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.337 1.055 . . . . 73.41 112.017 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.68 99.33 2.09 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.967 0.507 . . . . 63.14 110.563 178.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.1 m -70.5 143.95 90.93 Favored Pre-proline 0 CA--C 1.569 1.699 0 C-N-CA 123.436 0.694 . . . . 75.43 111.381 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.24 113.31 2.0 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.755 2.303 . . . . 71.31 113.406 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 CA--C 1.564 1.5 0 C-N-CA 123.771 0.828 . . . . 74.31 111.562 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 110.411 -0.218 . . . . 74.42 110.411 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.02 116.78 6.09 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-O 120.191 -0.227 . . . . 54.25 112.676 175.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.5 p -61.64 -31.01 71.09 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.718 0.807 . . . . 55.33 112.451 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -77.94 110.59 12.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.184 0.593 . . . . 73.54 109.984 174.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -64.45 -30.46 71.49 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.687 0.756 . . . . 73.14 109.987 170.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -50.32 -45.57 54.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 125.242 1.417 . . . . 54.35 111.985 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -71.07 -47.45 58.27 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.257 1.023 . . . . 55.02 111.357 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm -58.19 -40.39 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.819 0.848 . . . . 74.43 112.214 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.3 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.03 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.412 HG12 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.24 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 64.12 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.671 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 72.34 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.02 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.414 HD22 ' HG ' ' A' ' 101' ' ' LEU . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 61.03 112.18 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.671 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.02 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.42 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.1 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 65.14 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 74.53 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.31 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 61.34 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 61.44 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.31 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 52.51 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.45 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 72.22 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.43 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.523 HG11 ' CE2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 61.33 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.31 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.13 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.52 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.15 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 55.12 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.34 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.619 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.33 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 71.24 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 52.22 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.523 ' CE2' HG11 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.21 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 42.3 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 73.2 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 72.4 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.44 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 60.23 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.601 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.01 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.1 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 62.12 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 64.43 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.24 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.11 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.412 HG23 HG12 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 53.13 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.509 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.43 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 64.24 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 65.53 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.53 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 63.44 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.509 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.54 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.24 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 62.13 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.51 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.2 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 72.25 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 64.42 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 HG13 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 73.32 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.55 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 35.11 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.601 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 63.04 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 51.0 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 65.02 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 72.42 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 61.24 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 62.02 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 64.31 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.457 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 63.24 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.619 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 53.25 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.23 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 63.54 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.788 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.788 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.24 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 54.53 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.457 HG13 ' HG2' ' A' ' 75' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.2 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 73.24 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 70.04 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.44 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.45 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 60.43 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.54 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 73.11 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.21 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 72.24 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 62.24 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 71.41 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.45 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.11 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 61.43 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.14 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.14 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 70.14 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.454 ' O ' ' HD2' ' A' ' 104' ' ' LYS . 0.7 OUTLIER -74.3 -37.73 63.55 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 53.33 110.116 -174.265 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.414 ' HG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tm? -58.47 -50.74 72.63 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.305 0.642 . . . . 73.31 109.782 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.58 -28.94 66.02 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.031 0.932 . . . . 61.22 111.558 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -73.49 -28.38 61.89 Favored 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 123.78 0.832 . . . . 43.34 111.964 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 100' ' ' GLU . 1.2 mptp? -67.27 -45.53 76.37 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 118.459 0.572 . . . . 72.42 109.933 167.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.2 t -64.74 -21.63 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 123.732 0.813 . . . . 70.1 111.82 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 37.2 t -61.76 -30.86 71.07 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.422 0.689 . . . . 52.44 112.36 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 161.05 77.99 0.03 OUTLIER Glycine 0 CA--C 1.535 1.307 0 CA-C-O 120.195 -0.225 . . . . 62.33 112.977 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 28.4 t -103.53 115.36 30.38 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.303 0.641 . . . . 72.24 110.814 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -92.08 -11.32 36.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.206 0.602 . . . . 72.53 111.647 176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 57.63 74.2 0.43 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.841 1.257 . . . . 53.24 111.674 -176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.0 m -80.08 122.71 83.36 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 116.159 -0.473 . . . . 71.33 109.938 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -75.89 17.31 0.71 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 123.077 2.518 . . . . 74.43 114.035 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 . . . . . 0 CA--C 1.564 1.515 0 C-N-CA 123.945 0.898 . . . . 75.41 110.442 177.82 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.443 -0.577 . . . . 74.21 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.29 79.91 0.1 OUTLIER Glycine 0 N--CA 1.478 1.476 0 CA-C-O 120.05 -0.305 . . . . 65.35 112.969 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.522 ' HB3' HD11 ' A' ' 8' ' ' ILE . 23.8 t 64.16 -176.03 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.419 1.087 . . . . 44.03 112.357 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -93.83 107.79 19.64 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.554 -0.717 . . . . 71.34 109.844 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 113.365 0.876 . . . . 72.04 113.365 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.56 -42.58 99.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.966 0.348 . . . . 65.23 111.647 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -59.38 -44.39 92.76 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.938 0.495 . . . . 72.04 110.651 174.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 3' ' ' SER . 90.8 mt -58.34 -45.77 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.744 0.818 . . . . 64.34 111.114 176.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.31 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.03 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.43 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.677 HG23 HD21 ' A' ' 101' ' ' LEU . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.41 110.63 170.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 71.13 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.13 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.665 HD22 ' HG ' ' A' ' 101' ' ' LEU . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.53 112.081 172.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.41 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.34 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 60.45 111.064 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.02 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 72.45 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 74.24 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 71.05 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 54.2 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.33 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.469 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 64.54 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.653 HG21 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.42 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.32 111.474 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.44 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.556 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 63.34 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 54.41 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 64.3 111.35 164.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.11 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.13 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.2 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 64.2 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.32 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.2 111.797 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.1 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.556 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.52 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.31 109.726 170.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.05 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 54.41 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.35 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.51 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.31 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG13 HD12 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 70.22 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 62.5 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 62.51 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.12 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.43 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.05 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.11 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.43 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 72.44 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.466 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.22 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.34 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 70.43 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.12 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.14 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.31 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 70.41 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 62.34 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 60.3 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.23 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.22 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 71.42 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.05 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 43.21 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 67' ' ' THR . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 72.33 110.783 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.15 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 65.43 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.4 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.547 ' HE2' HG23 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 60.04 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.553 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 72.34 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 73.01 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 71.1 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.77 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 51.34 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.77 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.13 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 70.21 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.547 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 62.04 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.495 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.3 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 61.34 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.401 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 62.3 109.651 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 70.11 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 53.41 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 63.22 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.653 ' HG2' HG21 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 60.05 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 73.53 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.11 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.4 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.51 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 71.03 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.13 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 71.02 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.12 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' LYS . 20.3 tp10 -68.46 -39.11 81.56 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 71.52 111.398 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.677 HD21 HG23 ' A' ' 12' ' ' THR . 1.8 tm? -72.54 -29.5 63.63 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.379 0.672 . . . . 63.11 110.816 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.7 -38.57 78.55 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.775 0.83 . . . . 72.54 111.818 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 100' ' ' GLU . 51.1 mtpt -61.25 -25.43 67.07 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.142 0.977 . . . . 71.23 112.935 -179.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.4 mmtt -62.63 -42.49 99.62 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.317 0.647 . . . . 73.1 112.227 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.3 t -91.03 -69.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 109.723 -0.473 . . . . 75.25 109.723 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t 60.78 -76.9 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.084 1.354 . . . . 73.51 112.415 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.33 -156.03 20.22 Favored Glycine 0 C--N 1.352 1.461 0 O-C-N 122.364 -0.21 . . . . 54.43 113.083 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 78.3 p -88.72 165.44 14.74 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 75.13 111.599 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 64.0 -75.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.852 1.261 . . . . 71.33 112.351 -178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 78.9 mt -75.1 91.28 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.248 0.547 . . . . 61.52 111.239 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -129.28 147.25 64.26 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 124.335 1.054 . . . . 60.51 109.559 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -55.83 135.55 70.15 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 122.611 2.207 . . . . 74.43 112.976 173.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? . . . . . 0 CA--C 1.568 1.64 0 C-N-CA 124.1 0.96 . . . . 73.5 112.828 -172.553 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 tpt . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 119.808 -0.139 . . . . 52.44 110.893 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.54 -9.96 4.64 Favored Glycine 0 C--N 1.355 1.593 0 CA-C-O 119.544 -0.587 . . . . 62.01 114.482 175.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -77.43 73.84 4.0 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.895 0.855 . . . . 71.11 110.7 176.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.477 ' O ' HD13 ' A' ' 8' ' ' ILE . 30.3 t-80 -74.08 -39.38 63.47 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.029 -0.987 . . . . 74.24 111.005 -177.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -63.86 -31.47 72.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.978 0.511 . . . . 71.31 111.319 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.71 -39.23 62.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.842 0.857 . . . . 74.52 111.25 172.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -56.45 -38.53 71.77 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.867 0.867 . . . . 74.15 111.503 174.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.477 HD13 ' O ' ' A' ' 4' ' ' HIS . 1.4 mp -54.0 -50.61 52.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 C-N-CA 123.978 0.911 . . . . 63.12 110.721 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 51.32 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 70.41 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 52.22 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 62.15 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.34 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.13 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 61.24 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HE2' ' HG ' ' A' ' 101' ' ' LEU . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.44 111.341 175.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.4 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.45 HD21 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 65.2 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.575 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.43 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 65.22 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.22 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.412 HG12 HD22 ' A' ' 94' ' ' LEU . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 64.21 111.303 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 72.43 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.43 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.5 ' O ' HG23 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 62.03 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.531 HG21 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 73.32 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.44 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 65.42 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.53 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 73.3 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.35 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 72.21 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.31 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.43 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.1 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 71.43 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.404 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.4 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 43.42 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.53 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 72.53 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.44 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.49 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 72.21 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.34 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 74.34 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.34 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 53.55 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.501 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 65.11 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.34 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' HD21 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.41 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 55.43 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 73.32 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.23 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.13 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.464 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 62.14 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.02 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 63.13 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.43 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 52.01 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.464 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.42 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 61.01 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 63.45 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.419 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.51 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.12 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 65.54 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 74.23 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.43 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.41 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 73.35 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.41 ' HB ' HG11 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.23 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 64.04 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.42 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.402 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.33 111.192 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 52.1 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.04 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.46 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 72.22 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.6 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.2 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.404 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.21 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 73.43 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.13 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 73.11 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.34 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.44 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 63.14 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 52.31 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 52.21 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.14 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.6 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 54.51 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.42 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.44 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 45.41 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.52 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.531 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 71.23 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 73.22 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 52.44 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.45 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.3 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 71.44 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 53.13 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 71.22 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.76 -37.42 79.36 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.42 110.404 174.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.487 ' HG ' ' HE2' ' A' ' 16' ' ' LYS . 2.9 tm? -67.66 -34.93 77.91 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.678 0.791 . . . . 74.31 110.788 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -59.4 -48.94 79.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.632 0.373 . . . . 61.44 111.112 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.08 -31.97 72.83 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.638 0.375 . . . . 74.42 111.605 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.88 73.5 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 124.092 0.957 . . . . 61.1 110.523 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.2 m -90.47 -45.06 14.92 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.45 0 C-N-CA 122.64 0.376 . . . . 71.54 111.792 176.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -161.98 -65.7 0.05 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.215 1.006 . . . . 73.04 110.717 -178.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.29 130.82 2.89 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-N 115.711 -0.677 . . . . 41.3 112.066 -175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.0 m -75.72 85.52 2.73 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 117.577 0.688 . . . . 70.02 109.899 172.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -73.27 -34.05 65.59 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 115.105 -0.952 . . . . 74.11 111.275 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp 67.58 116.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.234 1.414 . . . . 42.15 112.547 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 15.4 m -60.94 111.74 4.63 Favored Pre-proline 0 CA--C 1.571 1.757 0 C-N-CA 123.239 0.616 . . . . 73.11 111.002 173.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 12.3 Cg_exo -71.64 -8.9 24.08 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 123.113 2.542 . . . . 62.24 114.522 -171.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 CA--C 1.572 1.794 0 CA-C-O 118.688 -0.672 . . . . 72.03 111.819 -175.405 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 120.312 0.101 . . . . 73.41 111.061 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.04 172.9 41.24 Favored Glycine 0 C--N 1.349 1.275 0 N-CA-C 113.655 0.222 . . . . 74.25 113.655 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 m -83.84 68.04 9.79 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.309 0.644 . . . . 62.43 111.375 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -79.91 103.22 9.66 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.886 0.474 . . . . 71.34 109.824 170.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -64.44 -31.02 72.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.15 0.58 . . . . 73.24 111.968 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.58 -41.72 99.12 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.501 0.72 . . . . 63.22 110.076 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 11' ' ' VAL . 82.6 t80 -60.5 -46.8 88.78 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.067 -0.97 . . . . 75.41 111.13 175.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.76 -36.43 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.444 0.698 . . . . 62.51 111.495 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.23 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 7' ' ' TYR . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 61.04 110.854 175.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.622 HG23 HD21 ' A' ' 101' ' ' LEU . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 42.24 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 65.54 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 64.11 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.32 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 73.34 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 71.51 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.24 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 54.33 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 65.53 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.13 111.94 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.568 HG13 HG23 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 64.12 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.13 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.23 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.23 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 91' ' ' LYS . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 62.35 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.41 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.44 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 64.12 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 60.43 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 63.54 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.34 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 64.5 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 65.32 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.01 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.735 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 63.32 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 64.4 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.44 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.542 ' HB3' HG13 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 2.6 t-20 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.12 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.45 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.568 HG23 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 65.0 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.33 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.2 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 72.43 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.572 HG13 HD12 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 51.24 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 72.12 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.426 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 63.5 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.0 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 55.54 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 54.51 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.13 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.559 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.31 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.21 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 51.21 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 72.01 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.14 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.559 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.34 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 61.43 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.44 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 55.45 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 60.41 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' HG23 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 63.55 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 73.23 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 65.24 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.11 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 54.22 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.42 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 61.34 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.3 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.542 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.35 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 62.3 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.742 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 51.01 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 35.42 112.083 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.735 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 74.12 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.453 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.33 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.34 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.707 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.41 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.742 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 62.23 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.51 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 ' N ' ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 73.25 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.01 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.444 ' HA ' HD12 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.45 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 70.33 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 70.51 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.51 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 65.23 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 63.34 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.15 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.668 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 63.01 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 72.33 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 74.12 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 65.03 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.486 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 71.33 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.22 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.41 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 61.11 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 72.54 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -61.47 -54.26 45.76 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.34 111.265 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.622 HD21 HG23 ' A' ' 12' ' ' THR . 18.2 tp -70.12 -26.91 64.17 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 115.436 -0.802 . . . . 75.0 111.23 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.82 -45.6 91.84 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.31 110.734 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -56.77 -39.25 73.7 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.86 0.864 . . . . 75.44 111.256 174.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.87 -49.11 69.25 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.758 0.823 . . . . 73.33 112.342 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.21 -21.0 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 122.856 0.462 . . . . 53.34 111.859 -178.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.7 t -82.44 137.47 34.68 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.12 0.568 . . . . 54.14 110.748 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.73 82.88 0.21 Allowed Glycine 0 CA--C 1.534 1.271 0 N-CA-C 111.898 -0.481 . . . . 52.54 111.898 173.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.2 m -101.98 109.7 21.49 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.519 0.728 . . . . 73.22 110.878 -172.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -91.32 -68.82 0.77 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.963 0.505 . . . . 74.02 110.163 173.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.4 mp 63.57 113.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.817 1.247 . . . . 64.0 111.827 -176.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -59.58 147.56 77.09 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 123.671 0.788 . . . . 74.25 112.487 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.93 -29.55 40.94 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.663 2.242 . . . . 73.54 113.871 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? . . . . . 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 75.15 109.444 175.343 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 110.12 -0.326 . . . . 45.2 110.12 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -110.82 150.38 17.75 Favored Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.216 -0.354 . . . . 71.11 112.216 176.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -78.25 159.33 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.616 0.366 . . . . 71.51 110.753 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.414 ' O ' HG12 ' A' ' 8' ' ' ILE . 80.9 m80 -62.32 -30.94 71.52 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.091 0.556 . . . . 63.41 111.543 173.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -63.41 -45.67 89.96 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.203 0.601 . . . . 74.52 111.195 172.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 17.3 tp10 -63.76 -37.41 87.25 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.944 0.898 . . . . 72.43 111.26 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.432 ' O ' HG23 ' A' ' 11' ' ' VAL . 71.8 t80 -60.89 -50.05 74.98 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.154 0.981 . . . . 74.15 110.762 174.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 4' ' ' HIS . 32.2 mm -60.27 -36.04 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.615 0.766 . . . . 73.24 112.187 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.35 111.578 173.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.31 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 7' ' ' TYR . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 70.11 112.158 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.43 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.22 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 54.25 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.01 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.22 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.54 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.41 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 94' ' ' LEU . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.54 111.57 174.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.22 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 59.1 m-80 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 53.43 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.42 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.53 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.41 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.43 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.45 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.44 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.24 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.53 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 62.31 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 61.02 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.51 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.11 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.42 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.44 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.474 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 63.21 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.54 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.564 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 63.25 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 51.31 110.041 173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 64.22 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.446 HG23 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 65.54 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.43 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 72.42 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.15 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 64.25 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 74.43 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.54 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.42 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 73.42 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.55 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 62.41 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 72.12 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.41 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.14 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 60.35 111.991 172.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.467 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.02 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 62.22 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 63.04 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 54.31 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 53.11 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.24 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.41 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 64.35 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.44 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 41.44 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.5 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 65.52 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 71.11 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 71.11 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.42 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 65.31 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.13 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.677 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 71.45 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 51.32 111.871 176.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.474 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.21 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.2 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 62.0 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.736 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.3 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.736 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.1 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.52 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.564 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 63.21 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 55.31 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.34 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.521 HD12 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.23 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.23 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 73.45 110.819 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.521 ' HD2' HD12 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 53.13 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 64.34 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.05 111.794 173.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 71.12 112.699 -176.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 70.34 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.424 HD11 HG23 ' A' ' 19' ' ' ILE . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 44.14 110.651 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.13 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 72.41 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.54 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 65.41 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.478 ' O ' ' HD3' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.04 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -41.95 80.4 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 61.31 109.729 174.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 114.97 -1.014 . . . . 75.51 111.219 173.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.04 -39.31 66.09 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.961 0.904 . . . . 65.44 111.851 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -67.37 -53.3 30.56 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.478 0.711 . . . . 75.43 111.846 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.92 -18.89 61.35 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.247 0.832 . . . . 64.42 113.247 -169.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 94.2 t -87.34 -37.95 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.243 0.617 . . . . 71.45 110.972 174.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 83.8 p -65.58 -27.47 68.45 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.574 0.35 . . . . 70.4 111.813 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.39 121.23 5.67 Favored Glycine 0 CA--C 1.537 1.433 0 N-CA-C 111.143 -0.783 . . . . 65.43 111.143 167.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 71.0 m -71.39 96.35 1.46 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 117.41 0.605 . . . . 72.4 112.383 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -161.18 162.55 31.35 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.72 0.808 . . . . 75.12 110.14 171.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.82 37.9 21.79 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.782 1.233 . . . . 72.5 112.011 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.429 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 23.7 m -62.01 134.54 94.38 Favored Pre-proline 0 CA--C 1.566 1.589 0 CA-C-N 115.393 -0.822 . . . . 71.43 111.736 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 24.3 Cg_exo -65.64 -11.03 28.73 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.978 2.452 . . . . 42.3 114.679 -175.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? . . . . . 0 CA--C 1.561 1.392 0 C-N-CA 123.736 0.815 . . . . 73.12 110.728 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 110.825 -0.065 . . . . 74.21 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.02 72.18 1.63 Allowed Glycine 0 C--N 1.354 1.578 0 O-C-N 123.173 0.295 . . . . 64.41 113.055 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 114.5 6.72 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.906 0.882 . . . . 71.5 111.371 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 68.82 27.03 5.81 Favored 'General case' 0 CA--C 1.568 1.649 0 C-N-CA 124.157 0.983 . . . . 71.42 111.934 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.635 0.774 . . . . 74.12 111.966 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -56.52 -31.74 64.41 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.192 0.997 . . . . 74.14 113.489 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -54.31 -47.14 72.77 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.4 0.68 . . . . 71.02 111.471 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm -59.66 -38.83 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 C-N-CA 123.951 0.9 . . . . 65.44 111.581 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.01 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 71.4 111.158 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.02 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 73.22 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.32 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 52.54 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 55.21 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.23 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 62.43 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 52.21 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.453 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.31 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 60.34 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.42 111.85 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.449 HG13 HG23 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.44 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.24 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.31 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 62.13 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 62.14 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 72.02 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.42 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.45 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.11 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 61.0 111.538 175.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.33 110.588 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 73.53 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.4 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.24 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.22 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.02 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.532 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.15 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.01 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.723 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.1 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.449 HG23 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.42 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.12 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.723 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 71.13 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 73.3 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.573 HG11 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.02 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.0 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.464 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 44.54 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 54.23 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 70.15 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.01 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.44 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.497 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 71.13 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.03 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 54.4 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.31 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.32 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.497 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.43 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.31 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.02 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.14 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 55.1 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 67' ' ' THR . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.22 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 62.52 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.13 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 72.34 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.599 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 64.32 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.32 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.34 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 72.42 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.25 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.44 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.42 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 60.2 112.519 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.739 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.15 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 71.04 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.42 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 62.15 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.466 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 72.23 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.23 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.03 108.767 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.14 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 45.3 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.23 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.33 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.14 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.53 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.44 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.429 HG13 HG23 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 72.34 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 65.11 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 60.53 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.599 ' HB3' HD11 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 73.34 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.453 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 64.24 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 54.03 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.31 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.15 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 72.1 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -66.54 -44.01 83.59 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.33 110.212 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.1 tp -72.32 -41.85 66.1 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.278 0.631 . . . . 65.33 111.188 176.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.1 -25.85 65.52 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.271 0.629 . . . . 71.31 111.46 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -57.95 -35.0 70.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.356 0.663 . . . . 70.01 111.011 173.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -77.44 -30.24 53.25 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.863 0.865 . . . . 74.33 111.87 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.7 -66.03 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.55 0.74 . . . . 71.33 110.163 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.4 m -76.54 81.37 3.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.096 0.958 . . . . 75.24 110.867 172.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.62 -145.68 11.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 115.789 -0.641 . . . . 62.13 112.671 176.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.5 m 52.02 66.56 1.17 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.183 0.993 . . . . 71.02 111.483 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 61.03 -82.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.73 1.212 . . . . 75.54 111.17 -173.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.69 164.86 36.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.33 1.052 . . . . 54.51 111.039 177.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.57 147.93 64.6 Favored Pre-proline 0 N--CA 1.486 1.36 0 C-N-CA 123.263 0.625 . . . . 52.22 111.681 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.97 105.64 0.15 Allowed 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.19 2.593 . . . . 73.11 113.113 175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.352 0 C-N-CA 123.769 0.828 . . . . 62.23 109.039 -174.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.509 0.195 . . . . 71.41 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.63 -100.04 0.56 Allowed Glycine 0 CA--C 1.539 1.552 0 N-CA-C 113.954 0.342 . . . . 65.01 113.954 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 t -87.42 172.09 10.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.535 0.734 . . . . 45.31 112.575 -175.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -115.67 176.18 5.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 123.684 0.793 . . . . 72.53 112.088 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -62.87 -30.74 71.75 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.624 1.169 . . . . 74.24 113.898 -175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -68.15 -29.99 69.0 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.417 0.525 . . . . 74.25 112.417 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.421 ' O ' HG23 ' A' ' 11' ' ' VAL . 87.2 t80 -62.49 -49.08 76.8 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.387 0.675 . . . . 73.05 110.84 173.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.499 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm -59.69 -41.54 85.6 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.234 0 C-N-CA 123.865 0.866 . . . . 74.42 110.797 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 62.45 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.35 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 7' ' ' TYR . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.02 111.794 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.502 HG23 HD21 ' A' ' 101' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 53.14 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.32 113.413 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.33 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.33 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.44 111.456 -173.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.12 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.11 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.13 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.21 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.32 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.53 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.43 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.54 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.22 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.478 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.03 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 63.23 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.41 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.559 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 64.21 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.35 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 72.13 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.52 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 71.52 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HA ' HD13 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.31 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 54.25 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.04 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.01 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 71.53 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.559 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.41 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 65.1 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 63.51 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.31 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.51 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 71.14 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.12 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.635 HG11 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.42 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 73.43 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.31 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.15 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 70.13 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.54 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.401 HG23 HG12 ' A' ' 11' ' ' VAL . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.1 110.363 175.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.22 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.44 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.499 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 71.44 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.42 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.53 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 63.12 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.43 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 71.22 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.32 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' O ' HG23 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 71.52 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.633 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 73.52 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.401 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 46.1 t60 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 70.53 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.42 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG11 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.2 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 52.33 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.41 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.11 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 73.1 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.13 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 73.12 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 72.14 111.343 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.32 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 53.11 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.53 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.694 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.24 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.694 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.54 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 73.54 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.587 HG22 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 73.53 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 65.2 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.587 ' H ' HG22 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 70.52 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.44 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.13 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 72.03 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 63.41 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 64.55 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.02 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.478 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.23 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.53 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 73.4 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 73.2 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.14 109.279 170.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 64.24 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 64.34 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 61.32 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.2 111.821 -178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.37 -41.63 76.27 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.41 110.549 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.502 HD21 HG23 ' A' ' 12' ' ' THR . 0.4 OUTLIER -70.23 -37.17 74.93 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 122.979 0.512 . . . . 64.52 110.075 176.413 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.69 -36.13 75.86 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.75 0.82 . . . . 73.22 110.803 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -84.74 -22.92 29.5 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 123.972 0.909 . . . . 74.42 111.52 176.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -71.25 -37.86 71.93 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.807 0.843 . . . . 71.52 111.712 -175.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.1 m -65.16 -23.43 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.164 0.586 . . . . 75.01 111.687 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.0 t -87.7 90.68 8.47 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.267 0.627 . . . . 43.14 109.448 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.31 144.91 6.88 Favored Glycine 0 N--CA 1.479 1.538 0 CA-C-N 115.718 -0.674 . . . . 60.34 112.381 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 44.6 t -89.46 91.87 8.89 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-O 121.355 0.598 . . . . 61.31 111.008 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -96.37 33.5 1.77 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.133 0.973 . . . . 72.33 111.701 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.7 mp -86.87 54.05 3.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.798 0.839 . . . . 54.34 110.509 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.7 m -113.97 134.25 22.18 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 123.729 0.812 . . . . 75.45 110.991 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.61 -9.4 14.71 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.396 2.064 . . . . 75.23 112.38 171.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 . . . . . 0 CA--C 1.56 1.336 0 C-N-CA 124.127 0.971 . . . . 73.45 109.711 -179.333 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.8 ptp . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.863 0.363 . . . . 63.11 111.047 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.26 -123.71 1.22 Allowed Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.664 -0.52 . . . . 34.51 111.984 -176.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.8 m 61.27 -88.04 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.614 1.166 . . . . 74.22 110.791 -172.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 49.97 110.49 0.0 OUTLIER 'General case' 0 C--N 1.369 1.414 0 C-N-CA 125.362 1.465 . . . . 73.12 114.154 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -54.26 -29.0 45.29 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.375 0.67 . . . . 73.22 111.967 175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.77 -54.34 48.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.999 0.92 . . . . 43.42 110.543 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.09 -40.09 88.38 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.405 1.082 . . . . 74.21 111.547 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm -64.21 -45.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.384 0.674 . . . . 62.04 111.308 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.51 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 64.41 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.4 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.51 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.52 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.22 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.42 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 71.11 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 54.34 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 74.21 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.34 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.9 t30 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.44 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.21 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.13 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 71.33 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.498 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 62.44 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.43 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 71.13 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.14 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.522 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 60.45 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.14 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 70.15 111.509 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 70.45 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.32 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.02 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 70.24 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.54 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.24 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.23 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 54.24 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 22' ' ' VAL . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 64.31 111.111 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 62.35 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' HIS . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.01 112.271 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 73.1 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.575 HG13 HD12 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 71.13 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 44' ' ' ARG . 72.1 t60 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.11 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 71.31 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 61.02 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.3 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.52 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 62.05 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 60.21 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.1 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.03 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 74.41 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.538 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.33 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.33 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 65.32 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.24 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.04 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.32 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.575 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.55 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.14 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 63.1 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 73.02 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.01 110.402 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.12 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 73.24 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 55.13 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 72.51 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.23 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.406 ' HE2' HG23 ' A' ' 82' ' ' ILE . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 64.41 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 73.14 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.43 111.701 178.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.53 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.519 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.34 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 74.15 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 71.51 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.411 HD12 ' N ' ' A' ' 82' ' ' ILE . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.21 109.821 -175.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 70.0 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.452 ' HA ' HD12 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.52 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 71.23 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.51 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.35 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.05 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 72.42 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.11 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.33 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.42 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 63.54 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.23 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 65.35 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.51 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 61.41 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.51 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -34.67 61.19 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 71.31 109.568 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 tp -72.35 -29.45 63.81 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-O 121.021 0.439 . . . . 74.31 110.765 171.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.06 -32.59 73.04 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.632 0.773 . . . . 41.03 110.631 175.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.1 mmtm -64.6 -27.88 69.25 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.786 0.834 . . . . 64.14 112.078 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -69.86 -47.84 61.11 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.205 0.526 . . . . 75.32 110.352 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 58.2 t -65.69 -38.59 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.888 0.875 . . . . 74.25 111.18 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.1 t -74.38 -26.14 59.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.904 0.882 . . . . 53.44 112.003 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.55 68.36 1.52 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.572 -0.285 . . . . 42.33 112.463 -178.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.8 t -151.54 122.4 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.304 0.641 . . . . 64.11 110.392 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.58 137.68 40.95 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.705 0.802 . . . . 74.11 111.528 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.577 ' H ' HD23 ' A' ' 110' ' ' LEU . 2.4 pt? -79.59 132.7 36.34 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.391 0.676 . . . . 74.33 111.25 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 14.9 m -130.72 159.3 71.73 Favored Pre-proline 0 N--CA 1.492 1.667 0 C-N-CA 124.748 1.219 . . . . 74.34 110.8 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.7 82.33 0.32 Allowed 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 122.734 2.29 . . . . 74.1 114.081 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 . . . . . 0 CA--C 1.56 1.357 0 C-N-CA 124.271 1.029 . . . . 70.15 109.854 173.849 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtt . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.895 -0.409 . . . . 64.04 109.895 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.66 -123.08 4.09 Favored Glycine 0 N--CA 1.476 1.355 0 CA-C-O 119.86 -0.411 . . . . 74.33 112.369 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.0 p -68.62 99.1 0.95 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.437 0.695 . . . . 75.2 112.567 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -70.95 103.74 2.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.111 0.564 . . . . 72.34 110.943 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.507 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 49.3 mt-30 -64.51 -38.66 91.79 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.494 0.718 . . . . 74.2 110.887 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -50.57 -47.32 57.91 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.967 1.307 . . . . 63.32 111.818 173.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.1 t80 -59.84 -50.08 75.2 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.003 -0.998 . . . . 63.31 111.003 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -57.5 -45.06 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 123.931 0.892 . . . . 64.54 112.463 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 5' ' ' GLN . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.3 111.394 178.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 51.42 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 7' ' ' TYR . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 70.25 112.87 -176.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 53.51 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 70.12 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.21 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.481 HD21 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.24 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.41 ' HE3' HD23 ' A' ' 101' ' ' LEU . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.14 111.196 174.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.22 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.473 HD11 HD22 ' A' ' 45' ' ' LEU . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.13 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.509 HG23 HD13 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 72.33 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.34 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.23 112.075 -179.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 55.24 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.04 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 53.13 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 63.4 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.587 HG21 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.05 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.4 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 74.12 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.462 HG11 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.52 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.1 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 63.2 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.4 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.11 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 70.55 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.02 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.52 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.51 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 62.04 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.462 ' CE2' HG11 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.43 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.01 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 55.31 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 53.22 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 72.11 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 61.33 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD22 HD11 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.31 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.524 HG11 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.41 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 60.41 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.41 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.14 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 64.04 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 42.2 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 54.31 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.34 112.655 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.42 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.43 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.13 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 52.1 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.418 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.04 111.096 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.23 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.34 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 64.21 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 51.01 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 74.31 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.14 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.4 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 71.42 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.53 HD12 ' H ' ' A' ' 68' ' ' ILE . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 64.34 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 63.11 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 38.8 m-80 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 63.43 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 61.31 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.41 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 64.51 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.41 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.543 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 55.12 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.647 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 61.41 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 62.12 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.4 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.451 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.31 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.451 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.14 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.44 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.54 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.45 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.624 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 54.44 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.441 ' H ' HG22 ' A' ' 82' ' ' ILE . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.13 113.265 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 51.53 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.624 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.53 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.03 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.42 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 64.05 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.424 HG11 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.12 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.587 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 72.22 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.428 ' HB2' ' NZ ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 52.22 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 50.21 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.509 HD13 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 61.32 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 71.13 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.481 HG12 HD21 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.43 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.12 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.428 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 54.23 112.39 -173.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 103' ' ' LYS . 0.8 OUTLIER -80.37 -30.32 37.89 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.41 HD23 ' HE3' ' A' ' 16' ' ' LYS . 23.7 tp -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.436 0.636 . . . . 65.34 110.244 173.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 30.0 t70 -59.88 -29.47 68.34 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.078 0.951 . . . . 54.31 111.405 168.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.65 ' HG3' ' HB3' ' A' ' 109' ' ' TYR . 37.8 ttpt -73.78 -32.75 63.94 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.965 0.906 . . . . 73.32 111.872 173.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -48.29 79.71 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 123.325 0.65 . . . . 73.52 110.623 174.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.3 m -75.63 -21.16 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 CA-C-N 116.178 -0.465 . . . . 41.51 111.801 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 43.9 t -67.17 -18.06 65.11 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.367 0.667 . . . . 72.41 111.463 170.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.37 -60.08 4.35 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 111.611 -0.595 . . . . 50.13 111.611 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.6 t -156.65 92.73 1.32 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.586 0.755 . . . . 74.12 110.046 175.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.65 ' HB3' ' HG3' ' A' ' 103' ' ' LYS . 38.2 t80 -89.56 -63.65 1.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.978 0.511 . . . . 71.4 109.703 173.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.9 mt -132.93 108.0 8.65 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.582 0.753 . . . . 74.13 110.703 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -75.47 135.85 71.95 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.444 0.698 . . . . 73.53 111.903 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.09 94.76 0.96 Allowed 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.419 2.079 . . . . 72.13 113.074 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 . . . . . 0 CA--C 1.561 1.4 0 C-N-CA 124.116 0.966 . . . . 60.44 109.992 175.078 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 120.491 0.186 . . . . 72.31 111.029 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.84 115.64 0.44 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-O 119.559 -0.579 . . . . 63.3 112.195 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.11 -62.02 2.07 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 117.221 0.511 . . . . 73.34 111.326 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -140.39 -65.83 0.45 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.072 0.549 . . . . 63.02 111.535 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -64.95 -42.17 94.85 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.71 0.804 . . . . 73.23 111.056 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -64.75 -38.24 90.31 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.703 -0.68 . . . . 70.55 112.007 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.3 -50.0 69.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.621 0.368 . . . . 75.23 110.99 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm -60.71 -41.74 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 123.635 0.774 . . . . 65.45 110.777 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 51.25 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.42 112.569 -178.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.35 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 64.24 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 72.42 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.2 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.21 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.45 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.41 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.471 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 72.31 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HA ' HD21 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.45 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 65.23 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 70.44 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.407 HG13 HG23 ' A' ' 42' ' ' ILE . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 72.3 111.924 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 74.24 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.22 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.4 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.41 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.11 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 72.43 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 73.3 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.04 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.01 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.439 ' HA ' HG12 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 74.55 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.21 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.32 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.54 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 64.21 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.03 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 29' ' ' VAL . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.35 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 73.41 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.43 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.407 HG23 HG13 ' A' ' 22' ' ' VAL . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 71.1 112.024 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.1 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 64.41 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 71.04 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD12 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 62.31 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 43.31 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.471 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.21 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.15 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 71.44 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 74.53 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 71.44 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.537 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 61.51 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 65.0 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.03 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.21 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 15.51 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.537 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.14 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.52 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.23 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 73.03 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.24 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.45 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 54.53 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.565 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.44 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 71.15 110.952 177.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 54.25 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.435 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.43 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 60.23 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.33 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.34 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 73.12 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.03 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.22 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 65.24 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.593 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.22 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.31 112.233 -178.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 63.32 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.735 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 62.32 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.735 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 71.42 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 71.21 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 82' ' ' ILE . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 62.32 109.432 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.52 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 73.22 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.31 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.444 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 70.15 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.41 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 53.11 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.42 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 72.41 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.31 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' HG23 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 64.32 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.13 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.23 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.42 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.11 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 71.42 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.44 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -76.65 -27.99 55.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 65.41 110.917 178.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 ' HD3' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.43 -40.93 70.11 Favored 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 121.496 0.665 . . . . 65.22 109.364 173.416 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.65 -41.88 98.18 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.466 0.706 . . . . 51.25 110.396 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -64.17 -50.75 66.91 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.733 1.213 . . . . 64.24 112.242 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.459 ' HD3' HD22 ' A' ' 101' ' ' LEU . 0.0 OUTLIER -57.27 -30.07 64.37 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 113.824 1.046 . . . . 70.33 113.824 -168.591 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.65 -39.49 83.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.243 0 C-N-CA 123.344 0.658 . . . . 73.41 111.241 178.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 70.2 m -112.16 16.53 20.09 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.812 0.845 . . . . 54.04 111.583 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.18 101.7 2.11 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 116.508 -0.314 . . . . 54.41 113.525 -173.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 59.8 m -70.43 160.9 31.51 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.403 0.681 . . . . 64.11 111.705 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -82.13 97.61 8.28 Favored 'General case' 0 CA--C 1.562 1.431 0 CA-C-O 121.615 0.722 . . . . 65.53 110.09 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.6 mp -81.34 138.76 35.64 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 121.778 -0.576 . . . . 65.32 110.895 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.5 m -61.84 153.68 71.06 Favored Pre-proline 0 CA--C 1.566 1.558 0 C-N-CA 123.453 0.701 . . . . 72.51 110.983 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -65.2 84.21 0.19 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.466 2.111 . . . . 71.24 112.113 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 124.771 1.228 . . . . 74.3 110.185 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 110.459 -0.2 . . . . 65.53 110.459 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.62 125.52 37.25 Favored Glycine 0 CA--C 1.54 1.604 0 O-C-N 123.579 0.549 . . . . 73.14 113.347 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 t -73.04 78.16 1.21 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.665 0.786 . . . . 61.04 111.07 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -138.95 148.81 44.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.961 0.904 . . . . 63.24 111.243 -175.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -67.51 -29.11 68.44 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.562 0.745 . . . . 72.54 110.285 169.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -55.23 -37.91 67.79 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.671 1.188 . . . . 73.35 112.532 172.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -58.96 -48.25 82.2 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.443 0.697 . . . . 75.12 110.53 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.16 -38.32 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 114.832 -1.076 . . . . 73.41 111.639 -177.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 65.13 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 61.53 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.477 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 72.05 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.22 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.43 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 71.25 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.614 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 72.02 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.614 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 74.42 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.12 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HA ' HD12 ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 72.44 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.12 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 64.33 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 70.0 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.457 HG13 HG23 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.43 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.12 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.23 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 62.24 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.594 HG21 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.44 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 63.42 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.32 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.606 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 51.11 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.32 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 71.1 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.4 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 73.03 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.41 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.44 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.55 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.03 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.606 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.52 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.43 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.41 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.515 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 72.03 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.42 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 64.11 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.33 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.54 HG13 HD12 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 63.14 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 73.43 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.34 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 71.43 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.44 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 71.34 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 73.22 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 64.5 111.885 -178.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.53 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.22 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.31 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.24 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.412 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 72.44 111.46 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.44 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.1 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.31 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 51.43 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 70.55 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.13 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.54 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.14 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.33 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 63.22 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.468 HG21 HG21 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 32.32 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 40.15 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.34 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 60.52 110.762 -179.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.01 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 63.15 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.693 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 73.54 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.698 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 52.31 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.478 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.24 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 44.12 110.699 171.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 64.02 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 62.14 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.693 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.4 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 72.24 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.698 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.21 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.3 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.24 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.52 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.42 ' HG ' HD21 ' A' ' 71' ' ' LEU . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 63.12 111.454 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 51.13 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.53 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.44 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.422 HG13 HG23 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.12 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.594 ' HG2' HG21 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 72.04 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.11 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.53 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 73.53 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 65.45 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.01 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 55.13 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.45 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.24 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 -63.09 -43.49 98.36 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 55.22 111.702 -176.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.09 -43.06 65.39 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 122.678 0.391 . . . . 72.43 110.399 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -67.05 -25.87 66.47 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.043 0.537 . . . . 64.54 112.28 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -76.25 -36.58 58.41 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.176 0.991 . . . . 74.11 110.402 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -59.74 -37.04 77.88 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.616 0.766 . . . . 71.41 111.159 172.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.7 t -69.35 -68.32 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.168 0.587 . . . . 74.15 109.85 171.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 69.0 m -151.09 -70.04 0.17 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.218 1.007 . . . . 62.41 109.824 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.09 -94.04 0.17 Allowed Glycine 0 C--N 1.354 1.548 0 CA-C-N 115.984 -0.553 . . . . 62.13 113.765 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t 67.6 171.62 0.27 Allowed 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.459 1.504 . . . . 74.33 113.518 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -140.5 84.44 1.95 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 124.382 1.073 . . . . 72.25 110.149 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -73.97 106.55 5.72 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.822 -0.548 . . . . 54.11 109.66 -177.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.7 m -96.98 143.03 25.42 Favored Pre-proline 0 CA--C 1.563 1.457 0 C-N-CA 123.774 0.83 . . . . 71.34 110.644 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.86 -1.56 11.7 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.521 2.148 . . . . 73.21 113.845 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 . . . . . 0 CA--C 1.571 1.776 0 C-N-CA 123.922 0.889 . . . . 60.15 111.114 178.138 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 ttm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 110.585 -0.154 . . . . 60.34 110.585 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.27 71.14 2.5 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.178 0.299 . . . . 54.33 112.577 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -82.23 136.59 35.06 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.719 0.808 . . . . 74.23 111.352 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -131.73 144.31 50.88 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.604 0.761 . . . . 50.22 110.334 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -68.37 -34.55 76.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.704 0.402 . . . . 75.22 111.167 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.49 -35.37 75.78 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.201 0.6 . . . . 65.4 111.873 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -57.63 -52.28 66.06 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.157 0.583 . . . . 72.02 110.176 170.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.557 HG23 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt -57.68 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.916 0.886 . . . . 65.24 111.052 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 61.43 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 70.51 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.555 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.22 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.42 111.189 165.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.24 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 74.41 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 74.54 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.24 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.34 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.33 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.438 HG23 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.1 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 61.24 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 71.43 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.21 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 62.25 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.55 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.2 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.01 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.05 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.23 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.578 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.54 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 42.21 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.51 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 70.24 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 71.32 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HA ' HD12 ' A' ' 82' ' ' ILE . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.33 112.443 -173.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.11 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.02 111.984 -173.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 53.02 111.377 176.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 73.5 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.578 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.33 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.21 110.222 170.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.24 111.132 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.417 HG23 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 71.25 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.13 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.45 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.44 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.612 HG11 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.32 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 65.23 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.12 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 64.3 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.517 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 73.25 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.32 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' HG22 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.31 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 52.44 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 64.44 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 62.21 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.557 ' SD ' HG23 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 63.32 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 63.04 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.22 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 54.33 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.23 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.66 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 63.23 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.02 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.32 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 60.34 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 50.11 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 62.12 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.02 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.612 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 44.33 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.517 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.55 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.34 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 63.31 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 41.33 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 72.3 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 63.2 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.503 ' HB3' HD11 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 64.33 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 64.2 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 54.41 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.23 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.31 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 45.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 72.32 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.12 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 61.53 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.523 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 63.13 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.2 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.2 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 72.23 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 62.22 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 52.41 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 63.21 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.427 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.41 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.43 ' CB ' HD11 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.33 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HG ' HG23 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.23 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.03 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.51 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.14 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.21 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.427 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.54 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.66 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 -58.87 -46.77 87.0 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.24 110.874 174.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 105' ' ' VAL . 59.7 tp -70.99 -34.2 71.15 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.607 -0.724 . . . . 73.34 111.161 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.66 -54.34 48.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.797 0.839 . . . . 71.1 111.357 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -72.98 -18.44 61.36 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.33 0.652 . . . . 74.13 112.042 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -67.42 -41.72 84.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.004 0.522 . . . . 75.15 111.058 173.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 101' ' ' LEU . 87.6 t -63.83 -32.0 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.462 0.705 . . . . 42.2 110.955 175.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.0 m -64.32 152.69 40.53 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.125 0.57 . . . . 75.21 112.002 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.52 -84.6 0.49 Allowed Glycine 0 N--CA 1.476 1.346 0 CA-C-N 116.101 -0.5 . . . . 72.45 112.23 -179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.7 t -171.77 -59.16 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.692 0.797 . . . . 72.52 111.361 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.6 t80 74.69 -31.35 0.21 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.855 1.662 . . . . 75.24 113.053 -173.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.97 -47.02 84.98 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.295 0.638 . . . . 71.14 110.833 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.8 m -102.69 115.77 63.76 Favored Pre-proline 0 CA--C 1.564 1.492 0 C-N-CA 123.193 0.597 . . . . 33.52 110.839 175.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -80.19 165.36 21.43 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.85 2.367 . . . . 75.44 112.194 170.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 N--CA 1.497 1.886 0 C-N-CA 125.072 1.349 . . . . 73.3 112.303 177.13 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.493 1.692 0 N-CA-C 110.556 -0.164 . . . . 54.01 110.556 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.97 121.04 1.21 Allowed Glycine 0 C--N 1.35 1.338 0 CA-C-O 120.011 -0.327 . . . . 71.52 113.365 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.2 t -91.75 171.69 8.98 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.575 0.75 . . . . 73.1 110.813 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -87.3 100.79 12.97 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 63.34 111.127 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -70.03 -30.92 68.32 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.231 0.612 . . . . 74.15 111.782 178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 14.3 tp10 -62.71 -32.65 73.79 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.412 0.685 . . . . 61.34 111.481 176.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -68.04 -42.89 79.88 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.73 0.812 . . . . 70.44 110.813 173.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm -60.61 -43.02 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.18 0.592 . . . . 42.35 110.933 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 73.24 111.328 171.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 62.3 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 44.12 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 61.34 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.33 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.02 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.453 HD21 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.11 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 65.21 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.52 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 72.04 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.52 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.11 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.21 111.999 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.03 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.12 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.756 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.43 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.41 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.48 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.14 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.756 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.53 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.53 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.2 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 63.11 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 70.44 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.14 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 53.35 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 74.43 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.52 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.45 113.467 -170.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 64.13 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.14 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 63.21 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 64.11 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.53 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.43 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.04 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.3 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 71.54 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.02 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.22 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.525 ' HB ' HD21 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.42 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.12 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.42 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 70.34 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 70.02 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.31 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.44 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 71.3 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 64.13 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.11 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.43 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.11 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.52 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 64.15 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 62.25 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.51 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.42 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 71.42 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 74.33 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 60.03 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.45 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.412 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 73.14 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 50.42 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.32 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 72.24 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.04 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 62.1 111.747 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 51.51 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 52.31 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 61.02 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.602 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 64.54 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.602 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 64.45 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 64.22 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.475 HG21 ' HE1' ' A' ' 39' ' ' TRP . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 61.43 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.13 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 33.03 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.23 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.33 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.476 HD13 HG12 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.24 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.42 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.03 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.33 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.41 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 65.51 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.34 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.42 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 70.45 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.453 HG12 HD21 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.41 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 63.04 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.13 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.56 -26.83 41.3 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.32 111.229 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 105' ' ' VAL . 0.8 OUTLIER -66.35 -30.54 70.95 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 109.626 -0.509 . . . . 74.02 109.626 173.119 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -57.34 -37.13 72.08 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 123.572 0.749 . . . . 63.31 111.258 171.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -71.71 -35.02 70.07 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.56 0.744 . . . . 50.33 111.27 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.17 89.51 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.524 0.729 . . . . 75.33 110.153 176.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 101' ' ' LEU . 92.7 t -69.74 -55.58 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.588 0.755 . . . . 71.44 110.885 175.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m 60.21 94.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.577 1.151 . . . . 70.13 110.689 -170.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.32 75.91 1.14 Allowed Glycine 0 C--N 1.349 1.302 0 C-N-CA 122.967 0.317 . . . . 43.02 113.399 -175.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.0 t 65.6 1.39 1.72 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 125.648 1.579 . . . . 72.43 113.411 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -99.27 109.61 22.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.406 0.682 . . . . 74.34 110.873 -176.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 mp -110.51 -174.82 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.158 0.983 . . . . 71.01 109.92 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.4 m -120.8 153.36 56.98 Favored Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 123.572 0.749 . . . . 72.01 110.984 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -67.28 103.38 0.77 Allowed 'Trans proline' 0 C--N 1.383 2.35 0 C-N-CA 122.517 2.145 . . . . 71.44 112.206 174.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 . . . . . 0 CA--C 1.572 1.791 0 C-N-CA 125.018 1.327 . . . . 54.34 112.031 -178.831 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.485 1.289 0 N-CA-C 110.012 -0.366 . . . . 73.32 110.012 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.54 -114.21 6.64 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 116.082 -0.508 . . . . 54.33 112.951 -177.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.6 t -167.6 137.61 2.79 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.639 0.776 . . . . 74.44 111.541 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -127.71 172.22 10.99 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.686 1.195 . . . . 73.13 109.788 170.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.13 -40.92 74.52 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 112.978 0.732 . . . . 73.31 112.978 -175.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.481 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 15.1 tp10 -68.7 -42.7 77.38 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.216 0.607 . . . . 74.02 111.112 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -57.16 -42.83 81.81 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.822 0.849 . . . . 74.33 110.72 172.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.78 -49.31 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.301 1.04 . . . . 75.45 111.013 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.42 111.557 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.34 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 52.11 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.23 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 55.2 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.11 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 53.24 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 74.53 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.2 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.31 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' HD11 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 64.52 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 74.44 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.43 112.088 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.32 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.51 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 63.03 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.53 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.01 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.32 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 71.31 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.486 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.12 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.22 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 52.32 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 72.32 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.44 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.02 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.01 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.2 112.514 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.42 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.14 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.486 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.34 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.04 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.426 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 71.21 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 72.51 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 60.23 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 63.14 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.13 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.24 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 52.23 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.466 ' HB ' HD21 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.33 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.51 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.15 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 72.31 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 53.24 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.451 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 64.24 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 53.43 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.55 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.11 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 73.11 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.451 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.1 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.52 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.04 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.41 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 70.4 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 73.04 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 62.04 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 53.42 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.13 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.12 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.1 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.24 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.05 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.44 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.23 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.54 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG13 ' A' ' 80' ' ' ILE . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 53.54 112.321 172.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.32 111.905 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.12 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.3 111.692 -179.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 74.44 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.31 111.265 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 74' ' ' LYS . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 71.13 110.644 -169.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 61.22 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.53 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.42 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.1 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.34 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.12 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 65.04 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.44 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.448 HG13 HG23 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 72.24 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 73.55 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 54.32 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.24 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 53.4 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 55.11 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' MET . . . . . 0.463 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 62.04 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.15 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 62.03 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 71.44 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -73.04 -54.87 7.46 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 104' ' ' LYS . 40.3 tp -61.06 -27.84 68.64 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.615 0.766 . . . . 73.04 111.582 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.59 -40.43 65.66 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.47 1.108 . . . . 64.14 111.616 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -76.78 -38.66 53.63 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.53 0.732 . . . . 71.32 111.311 175.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.469 ' HB3' HD12 ' A' ' 101' ' ' LEU . 35.6 ttmt -65.35 -38.39 89.95 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.082 0.953 . . . . 55.34 113.057 -175.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.3 m -70.86 -15.52 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.281 0.633 . . . . 65.01 112.443 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.3 t -74.91 -27.07 60.07 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.994 0.517 . . . . 74.12 110.859 172.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.88 58.94 6.34 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-N 116.152 -0.476 . . . . 75.33 113.704 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.3 m -68.0 92.22 0.37 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.255 0.622 . . . . 75.13 110.686 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 60.02 91.76 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.055 1.342 . . . . 72.43 111.982 -178.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.521 ' H ' HD23 ' A' ' 110' ' ' LEU . 1.9 pt? -62.5 105.4 0.62 Allowed 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 121.744 0.783 . . . . 61.14 111.296 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.2 142.02 81.65 Favored Pre-proline 0 CA--C 1.56 1.351 0 CA-C-N 115.791 -0.64 . . . . 71.22 111.976 -177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.57 -28.96 25.55 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.211 1.94 . . . . 72.41 112.431 172.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 . . . . . 0 CA--C 1.571 1.767 0 C-N-CA 124.225 1.01 . . . . 71.13 110.482 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.439 0.162 . . . . 74.5 111.138 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.26 75.85 1.72 Allowed Glycine 0 C--N 1.352 1.42 0 CA-C-N 116.297 -0.41 . . . . 74.0 112.736 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -74.97 -44.56 47.66 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.917 0.887 . . . . 75.22 111.353 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -129.81 146.85 51.54 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.03 0.932 . . . . 75.02 111.153 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -63.08 -25.27 68.29 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.028 0.931 . . . . 42.35 111.834 171.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 1.9 mp0 -52.09 -38.46 57.33 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.372 1.069 . . . . 72.1 112.649 176.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.15 -44.16 97.22 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 122.7 0.4 . . . . 74.44 111.247 173.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt -60.17 -38.58 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.704 0.802 . . . . 74.13 111.037 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 73.31 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 60.31 111.706 179.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.41 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 53.42 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.14 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.23 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 61.13 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.2 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.4 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.51 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 72.4 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 65.3 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 61.32 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.4 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.42 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.42 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.43 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.622 HG21 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 43.4 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 65.34 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.44 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.557 HG12 HD13 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.45 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 65.23 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.2 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.33 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 73.51 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.535 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 64.25 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.52 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.41 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 62.33 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.44 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.32 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.34 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 64.33 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.458 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.24 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.419 ' HB2' HG11 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 60.11 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.12 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 53.54 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.57 HG11 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 72.01 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.04 110.5 171.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.561 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.13 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 65.41 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.53 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 61.11 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.444 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.4 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.2 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 34.14 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.2 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.444 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 71.11 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.42 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 61.15 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 32.13 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 72.13 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 62.15 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 70.32 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.557 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.32 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.52 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.24 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.57 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.13 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 54.1 110.866 172.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.24 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.423 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 44.15 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.12 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.43 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 71.01 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.549 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.13 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 70.44 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.42 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.44 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.04 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.547 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 52.11 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 73.03 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.549 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 71.33 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.41 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.515 ' HA ' HD12 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.14 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.44 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.54 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.33 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.557 HD13 HG12 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 72.53 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.11 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.54 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 70.51 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.622 ' HG2' HG21 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.44 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 72.43 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.511 ' O ' HG23 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 52.44 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD22 HG12 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.45 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.406 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.34 111.73 170.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 70.14 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.1 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 61.33 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.406 ' NH2' ' HB3' ' A' ' 95' ' ' ASP . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 73.33 112.835 -175.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.529 ' HA ' ' HE3' ' A' ' 103' ' ' LYS . 26.4 tp10 -64.28 -38.51 91.28 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 60.34 111.352 175.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -35.91 65.82 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-N 116.345 -0.389 . . . . 53.54 110.569 175.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.03 -41.69 97.33 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 111.979 0.362 . . . . 63.34 111.979 177.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . 0.529 ' HE3' ' HA ' ' A' ' 100' ' ' GLU . 17.3 ptpt -70.61 -26.41 63.48 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 122.634 0.374 . . . . 75.24 110.911 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -66.14 -47.19 74.88 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.074 0.949 . . . . 74.15 111.407 175.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.58 -46.52 82.85 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 C-N-CA 123.388 0.675 . . . . 75.21 110.921 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.7 t -159.0 126.6 4.93 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.574 0.749 . . . . 63.02 110.167 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.93 -81.02 0.73 Allowed Glycine 0 CA--C 1.54 1.606 0 N-CA-C 113.91 0.324 . . . . 52.24 113.91 -175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 63.4 m -146.08 177.38 9.01 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.293 0.637 . . . . 62.12 112.48 -173.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -165.05 -50.48 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.182 0.993 . . . . 75.31 111.06 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.91 90.07 0.12 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.55 0.74 . . . . 71.43 112.621 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 27.8 m -105.4 139.01 19.74 Favored Pre-proline 0 N--CA 1.483 1.188 0 C-N-CA 124.25 1.02 . . . . 75.1 110.585 177.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.83 -36.65 30.7 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.594 2.196 . . . . 62.14 112.579 172.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 . . . . . 0 N--CA 1.488 1.44 0 C-N-CA 124.024 0.93 . . . . 60.33 111.021 -178.745 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.3 mtm . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.717 0.294 . . . . 64.3 110.493 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.17 147.31 9.07 Favored Glycine 0 CA--C 1.538 1.531 0 N-CA-C 114.622 0.609 . . . . 62.12 114.622 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.3 p -71.85 135.25 46.54 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.099 0.56 . . . . 50.25 110.539 176.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -74.33 163.05 28.26 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.312 0.856 . . . . 73.53 113.312 -171.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -66.16 -39.02 89.47 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.083 -0.962 . . . . 53.04 111.551 -175.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -65.48 -32.59 74.27 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.082 0.553 . . . . 72.31 112.24 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 11' ' ' VAL . 45.6 t80 -60.48 -45.55 93.35 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.919 0.488 . . . . 72.13 110.787 171.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt -63.7 -40.3 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.165 0.986 . . . . 75.22 111.54 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 41.02 111.139 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.33 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 62.35 111.679 176.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.3 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.674 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 53.32 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.31 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 65.21 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 73.34 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 55.45 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 73.13 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 64.4 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.13 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.1 m-80 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.45 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.465 HG13 HG23 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 71.32 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.34 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.45 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.13 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.13 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 52.24 111.684 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.11 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 HD13 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.31 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.43 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 63.23 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.23 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.24 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 53.22 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 73.14 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.435 ' HE3' HD11 ' A' ' 82' ' ' ILE . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 62.14 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 54.44 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 73.33 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.474 ' CE2' HG11 ' A' ' 29' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.44 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.23 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.42 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.465 HG23 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 74.15 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.15 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 70.23 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 73.24 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.15 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.11 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.12 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.422 ' HB2' HD13 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 71.14 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 73.34 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 54.12 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 73.41 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 52.54 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 63.32 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.44 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 63.12 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.15 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.43 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.14 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.43 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.437 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.43 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 64.42 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.34 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 62.34 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 73.41 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.22 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.31 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 63.5 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 61.25 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.51 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.44 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 71.44 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 53.14 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 63.42 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.44 112.472 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 63.45 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.04 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.31 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.15 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 62.42 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 65.22 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 36' ' ' MET . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 72.0 110.135 -170.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.44 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 63.55 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.11 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 90' ' ' VAL . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 71.42 110.965 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.496 HD13 HG12 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.13 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.44 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 73.05 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 86' ' ' LEU . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 61.54 110.438 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 72.2 111.725 171.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 72.01 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 71.42 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.35 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.44 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.11 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.11 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 73.15 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.22 113.533 -176.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.4 -34.19 58.83 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.42 110.185 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.658 HD21 ' HE3' ' A' ' 16' ' ' LYS . 46.1 tp -62.89 -31.37 72.4 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.2 1.0 . . . . 71.54 111.495 171.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.426 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 20.9 t70 -57.3 -37.84 73.06 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.831 0.852 . . . . 65.32 111.892 175.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.4 -36.23 68.67 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 123.719 0.807 . . . . 71.41 111.945 178.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.522 ' HD3' HD12 ' A' ' 101' ' ' LEU . 50.3 mtpt -60.39 -47.0 87.97 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.817 0.847 . . . . 73.34 112.498 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.08 -18.05 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.165 0.586 . . . . 74.42 111.53 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.4 t -76.18 -33.38 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.667 0.787 . . . . 75.35 111.339 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.53 -36.65 4.26 Favored Glycine 0 C--N 1.35 1.309 0 CA-C-N 116.047 -0.524 . . . . 61.32 113.215 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.4 t -159.87 176.76 11.53 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.526 0.73 . . . . 71.53 110.87 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -85.43 103.14 14.05 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.56 0.744 . . . . 75.32 111.364 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.7 -39.89 30.23 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.317 -0.623 . . . . 71.13 109.317 169.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.3 m -116.97 143.41 31.54 Favored Pre-proline 0 CA--C 1.562 1.412 0 N-CA-C 108.688 -0.856 . . . . 65.44 108.688 159.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.87 -51.21 0.68 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.378 2.052 . . . . 70.05 113.295 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 . . . . . 0 CA--C 1.567 1.624 0 C-N-CA 123.71 0.804 . . . . 75.12 110.729 -169.227 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.558 0.694 . . . . 65.4 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.08 54.01 4.51 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 121.968 -0.458 . . . . 71.34 112.068 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m 52.82 -84.19 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.974 1.31 . . . . 63.34 112.163 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -148.09 -59.67 0.25 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.312 1.045 . . . . 73.3 110.037 175.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -72.32 -44.95 61.95 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.834 0.854 . . . . 75.12 112.107 -177.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.71 -30.54 71.63 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.725 0.41 . . . . 63.42 110.935 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -56.8 -55.37 35.21 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.882 0.873 . . . . 75.24 110.39 171.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm -59.01 -37.31 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.967 0.907 . . . . 74.11 112.014 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 71.44 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.31 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.33 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.1 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.4 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.45 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 51.23 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.52 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.14 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.11 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.04 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.34 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 73.54 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.482 HG13 HG23 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 62.45 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 62.32 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 62.33 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.47 ' O ' HG23 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 72.43 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 73.33 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 70.44 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.1 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.552 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 63.51 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.22 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 62.25 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 61.41 110.352 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 29' ' ' VAL . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 54.22 114.723 -171.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.35 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 64.42 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.652 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.23 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 71.12 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.43 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.552 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 73.02 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.35 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.51 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.482 HG23 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 64.35 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 60.0 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 54.44 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.607 HG11 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.33 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 72.13 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 72.12 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 72.33 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 50.14 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.35 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 72.31 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.532 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.4 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.34 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 72.44 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 60.14 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.54 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.532 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.13 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.42 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 54.34 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.415 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 62.31 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.04 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 67' ' ' THR . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 64.21 111.992 175.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 54.25 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.23 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.45 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 63' ' ' LYS . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 62.12 110.511 175.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.607 ' HB ' HG11 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.32 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.411 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 73.05 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 52.41 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 74.42 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 63.21 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.53 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 64.3 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.422 ' HE2' HG23 ' A' ' 82' ' ' ILE . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 61.12 112.152 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.652 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 61.31 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.23 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.41 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.66 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 63.13 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 62.34 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.31 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 55.42 109.52 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.404 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 63.23 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 42.52 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.45 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.639 HD12 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 64.3 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.52 HD12 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 61.11 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 54.21 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.639 ' HD2' HD12 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 74.03 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.22 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.04 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 74.04 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 72.33 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 71.34 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.485 ' N ' HD12 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.13 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 43.12 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.12 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.11 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.41 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.24 -46.83 78.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 61.43 110.633 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 tp -67.24 -39.12 86.15 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.396 0.678 . . . . 73.45 110.947 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -59.32 -37.92 78.99 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.949 0.9 . . . . 70.11 111.051 172.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -77.27 -19.88 55.88 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 71.15 111.459 179.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -79.31 -29.94 42.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.892 0.477 . . . . 73.45 111.699 172.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.5 t -89.6 -65.74 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.115 0.566 . . . . 71.55 111.006 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.1 t -69.54 -25.9 64.24 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.306 1.042 . . . . 61.34 112.786 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.32 74.1 2.11 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 114.624 0.61 . . . . 51.41 114.624 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t -126.46 89.39 3.0 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.96 0.904 . . . . 64.1 108.79 172.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -134.65 176.78 8.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.873 0.869 . . . . 75.32 110.982 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.2 63.06 1.99 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.664 1.185 . . . . 72.33 111.802 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 22.5 m -111.88 142.52 26.87 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 123.237 0.615 . . . . 71.34 112.142 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -74.16 154.14 46.67 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 123.24 2.626 . . . . 75.14 112.61 170.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.565 1.54 0 C-N-CA 123.164 0.586 . . . . 64.43 109.626 177.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.439 0.161 . . . . 75.1 111.072 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.91 99.53 0.18 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 113.815 0.286 . . . . 72.01 113.815 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.9 m -128.33 29.98 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.362 1.065 . . . . 72.42 109.943 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -62.46 -45.86 91.15 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.709 0.804 . . . . 74.22 111.175 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 75.7 mt-30 -58.78 -50.87 72.33 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.276 0.63 . . . . 72.14 111.078 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.437 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 40.8 tt0 -52.21 -50.73 61.36 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.766 0.826 . . . . 64.44 111.656 177.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -53.84 -50.49 66.09 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.154 0.982 . . . . 75.51 111.496 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt -63.77 -38.96 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.591 0.756 . . . . 73.22 111.863 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 5' ' ' GLN . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 70.22 111.885 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 71.51 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 62.45 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.52 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.601 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 54.21 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.41 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 55.44 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 54.25 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.32 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.52 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.22 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 71.13 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.12 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.52 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.02 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 54.53 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.22 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.15 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.41 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 65.51 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 64.42 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 62.22 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.42 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 70.54 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.402 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 60.33 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.14 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 71.45 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 74.11 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.574 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.34 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 64.44 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.42 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.13 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.42 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.44 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.52 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 74.1 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.43 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.31 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 64.11 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 72.32 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.22 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.42 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.416 ' O ' HG22 ' A' ' 53' ' ' THR . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.23 110.601 173.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 74.41 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 61.04 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 72.21 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.23 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.32 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 53.25 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.15 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 41.52 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.21 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.33 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.33 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 64.23 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 60.15 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.22 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 51.41 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.24 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.12 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.14 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.4 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 64.25 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 71.12 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.452 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 71.21 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 70.01 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 54.41 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.24 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 71.3 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.11 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 35.42 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 34.01 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.713 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 71.24 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.713 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.21 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.15 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 ' HE1' ' A' ' 36' ' ' MET . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.43 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.491 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 62.33 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.11 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.11 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.3 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.427 HD13 HG12 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 70.33 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.22 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.476 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.33 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.41 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 70.52 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.4 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 62.15 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 65.35 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 64.21 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.31 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 64.42 110.475 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.42 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -65.84 -45.86 80.65 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.03 109.798 171.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 97' ' ' VAL . 83.1 mt -59.03 -35.51 73.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.573 0.749 . . . . 62.24 111.12 174.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -44.27 92.63 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.669 0.787 . . . . 72.34 111.378 176.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -65.95 -34.44 78.13 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.004 0.521 . . . . 62.02 111.752 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -81.9 -36.99 27.52 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.148 0.579 . . . . 74.13 112.409 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.8 -22.28 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.736 -0.602 . . . . 71.45 110.445 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -70.64 -29.25 65.56 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.785 0.834 . . . . 72.33 111.762 172.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 176.15 80.27 0.05 OUTLIER Glycine 0 C--N 1.355 1.626 0 N-CA-C 114.212 0.445 . . . . 74.1 114.212 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 70.9 p -107.41 155.82 19.61 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.79 0.836 . . . . 73.14 111.002 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -147.33 125.96 12.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.554 0.742 . . . . 74.53 110.701 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.9 mt -96.56 119.39 34.96 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.427 0.691 . . . . 44.24 110.941 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.1 158.43 49.79 Favored Pre-proline 0 CA--C 1.565 1.544 0 C-N-CA 123.683 0.793 . . . . 73.1 110.728 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -61.57 -38.01 65.52 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 122.408 2.072 . . . . 51.53 113.491 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? . . . . . 0 N--CA 1.49 1.565 0 C-N-CA 123.35 0.66 . . . . 71.41 109.938 174.347 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.654 0.264 . . . . 75.109999999999999 111.442 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 60.200000000000003 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 73.519999999999996 111.388 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 73.010000000000005 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.209999999999994 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.299999999999997 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.099999999999994 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.209999999999994 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.140000000000001 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 54.530000000000001 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD11 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 50.420000000000002 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 63.539999999999999 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.430000000000007 111.702 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.519999999999996 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 65.439999999999998 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 52.420000000000002 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.340000000000003 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 51.5 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.129999999999995 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.340000000000003 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.549 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 73.530000000000001 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 72.299999999999997 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.150000000000006 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 72.109999999999999 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.409999999999997 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.451 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.340000000000003 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.519999999999996 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.019999999999996 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 63.009999999999998 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.329999999999998 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.549 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.439999999999998 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 64.129999999999995 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.420000000000002 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.489 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.109999999999999 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 61.310000000000002 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 72.329999999999998 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.230000000000004 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.662 HG11 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.120000000000005 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.409999999999997 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 71.010000000000005 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 72.140000000000001 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.400000000000006 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 54.25 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.427 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.239999999999995 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 73.219999999999999 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 65.120000000000005 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 53.210000000000001 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.109999999999999 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.427 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 64.439999999999998 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 73.299999999999997 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 70.409999999999997 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 64.420000000000002 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.439999999999998 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 63.32 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 HG13 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 71.230000000000004 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.430000000000007 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 72.239999999999995 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.662 ' HB ' HG11 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.129999999999995 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 62.539999999999999 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 55.530000000000001 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 71.340000000000003 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.319999999999993 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 54.409999999999997 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.420000000000002 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 74.299999999999997 111.89 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.611 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 55.409999999999997 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.44 ' N ' HD22 ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.340000000000003 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.120000000000005 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 74.310000000000002 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 62.039999999999999 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.409999999999997 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 34' ' ' GLU . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 72.150000000000006 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.340000000000003 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 72.109999999999999 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 62.009999999999998 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 63.520000000000003 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.43 HD13 HG12 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 44.340000000000003 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.219999999999999 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.040000000000006 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 72.530000000000001 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.340000000000003 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.129999999999995 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 64.010000000000005 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.319999999999993 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.519999999999996 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 61.420000000000002 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 71.310000000000002 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.109999999999999 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 70.319999999999993 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.708 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 . . . . . 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.019999999999996 110.134 175.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 112.119 0.414 . . . . 51.310000000000002 112.119 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 63.530000000000001 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.239999999999995 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.25 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 72.109999999999999 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.59 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 70.420000000000002 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.433 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 40.020000000000003 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.59 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 73.430000000000007 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 53.450000000000003 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 53.100000000000001 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.530000000000001 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.319999999999993 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.129999999999995 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.219999999999999 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.209999999999994 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.53 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 64.439999999999998 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 72.150000000000006 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 61.149999999999999 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 71.219999999999999 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 72.519999999999996 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.48 HG11 ' CE2' ' A' ' 39' ' ' TRP . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 73.530000000000001 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 63.149999999999999 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.439999999999998 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 61.340000000000003 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.319999999999993 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 43.43 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.654 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 72.150000000000006 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.601 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.420000000000002 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.219999999999999 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 74.329999999999998 111.57 171.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.54 HG23 HG13 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.349999999999994 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.439 ' HB2' HG11 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.319999999999993 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.109999999999999 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 54.140000000000001 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.709 HG11 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.540000000000006 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.030000000000001 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.299999999999997 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 62.43 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 71.430000000000007 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 71.120000000000005 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.140000000000001 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.099999999999994 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.010000000000005 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.120000000000005 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 50.399999999999999 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 41.43 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.425 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.140000000000001 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.420000000000002 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.120000000000005 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 55.520000000000003 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 73.329999999999998 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 43.450000000000003 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.450000000000003 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.510000000000005 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.140000000000001 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.709 ' HB ' HG11 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.409999999999997 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.310000000000002 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.230000000000004 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 72.349999999999994 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 72.420000000000002 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 72.430000000000007 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.582 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 54.43 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 73.209999999999994 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.040000000000006 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 40.43 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.793 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.109999999999999 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.793 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 71.030000000000001 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 71.230000000000004 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.606 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 53.420000000000002 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 44.240000000000002 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.319999999999993 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.400000000000006 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.436 HD23 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.430000000000007 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.601 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 71.230000000000004 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.019999999999996 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 64.420000000000002 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.402 HG13 HG23 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.200000000000003 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 71.239999999999995 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 51.020000000000003 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 73.239999999999995 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.329999999999998 111.754 174.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.530000000000001 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.329999999999998 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 61.549999999999997 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 63.229999999999997 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 72.510000000000005 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 . . . . . 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 112.214 0.45 . . . . 74.430000000000007 112.214 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.299999999999997 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.030000000000001 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.412 HG12 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.239999999999995 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 64.120000000000005 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.671 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 72.340000000000003 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.019999999999996 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 61.030000000000001 112.18 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.671 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.019999999999996 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.420000000000002 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.099999999999994 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 65.140000000000001 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 74.530000000000001 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.310000000000002 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 61.340000000000003 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 61.439999999999998 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.310000000000002 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 52.509999999999998 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.450000000000003 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 72.219999999999999 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.430000000000007 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.523 HG11 ' CE2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 61.329999999999998 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.310000000000002 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.129999999999995 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.519999999999996 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.150000000000006 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 55.119999999999997 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.340000000000003 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.619 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.329999999999998 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 71.239999999999995 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 52.219999999999999 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.523 ' CE2' HG11 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.209999999999994 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 42.299999999999997 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 73.200000000000003 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 72.400000000000006 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.439999999999998 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 60.229999999999997 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.601 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.010000000000005 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.099999999999994 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 62.119999999999997 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 64.430000000000007 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.239999999999995 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.109999999999999 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.412 HG23 HG12 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 53.130000000000003 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.509 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.430000000000007 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 64.239999999999995 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 65.530000000000001 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.530000000000001 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 63.439999999999998 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.509 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.540000000000006 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.239999999999995 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 62.130000000000003 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.510000000000005 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.200000000000003 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 72.25 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 64.420000000000002 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 HG13 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 73.319999999999993 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.549999999999997 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 35.109999999999999 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.601 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 63.039999999999999 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 51.0 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 65.019999999999996 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 72.420000000000002 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 61.240000000000002 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 62.020000000000003 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.568 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 64.310000000000002 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.457 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 63.240000000000002 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.619 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 53.25 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.230000000000004 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 63.539999999999999 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.788 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.788 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.239999999999995 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 54.530000000000001 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.457 HG13 ' HG2' ' A' ' 75' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.200000000000003 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 73.239999999999995 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 70.040000000000006 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.439999999999998 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.450000000000003 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 60.43 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.539999999999999 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 73.109999999999999 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.209999999999994 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 72.239999999999995 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 62.240000000000002 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 71.409999999999997 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.450000000000003 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.109999999999999 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 61.43 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.140000000000001 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.140000000000001 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 70.140000000000001 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 53.329999999999998 110.116 -174.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.415 HG23 ' SD ' ' A' ' 56' ' ' MET . 90.8 mt . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 120.351 0.119 . . . . 64.340000000000003 111.114 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.310000000000002 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.030000000000001 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.430000000000007 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.409999999999997 110.63 170.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 71.129999999999995 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.129999999999995 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.530000000000001 112.081 172.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.409999999999997 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.340000000000003 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 60.450000000000003 111.064 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.019999999999996 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 72.450000000000003 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 74.239999999999995 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 71.049999999999997 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 54.200000000000003 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.329999999999998 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.469 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 64.540000000000006 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.653 HG21 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.420000000000002 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.319999999999993 111.474 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.439999999999998 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.556 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 63.340000000000003 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 54.409999999999997 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 64.299999999999997 111.35 164.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.109999999999999 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.129999999999995 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.200000000000003 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 64.200000000000003 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.319999999999993 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HA ' HD22 ' A' ' 40' ' ' ASN . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.200000000000003 111.797 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.099999999999994 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.556 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.519999999999996 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.455 HD22 ' HA ' ' A' ' 37' ' ' GLU . 54.7 m-80 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.310000000000002 109.726 170.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.049999999999997 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 54.409999999999997 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.349999999999994 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.510000000000005 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.310000000000002 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG13 HD12 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 70.219999999999999 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 62.5 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 62.509999999999998 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.120000000000005 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.430000000000007 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.049999999999997 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.109999999999999 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.430000000000007 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 72.439999999999998 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.466 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.219999999999999 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.340000000000003 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 70.430000000000007 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.120000000000005 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.140000000000001 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.310000000000002 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 70.409999999999997 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 62.340000000000003 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.553 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 60.299999999999997 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.230000000000004 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.219999999999999 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 71.420000000000002 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.049999999999997 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 43.210000000000001 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 67' ' ' THR . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 72.329999999999998 110.783 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.150000000000006 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 65.430000000000007 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.400000000000006 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.547 ' HE2' HG23 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 60.039999999999999 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.553 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 72.340000000000003 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 73.010000000000005 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 71.099999999999994 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.77 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 51.340000000000003 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.77 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.129999999999995 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 70.209999999999994 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.547 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 62.039999999999999 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.495 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.299999999999997 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 61.340000000000003 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.401 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 62.299999999999997 109.651 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 70.109999999999999 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 53.409999999999997 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 63.219999999999999 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.653 ' HG2' HG21 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 60.049999999999997 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 73.530000000000001 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.109999999999999 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.400000000000006 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.509999999999998 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 71.030000000000001 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.129999999999995 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 71.019999999999996 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.120000000000005 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 20.3 tp10 . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 71.519999999999996 111.398 -179.314 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.4 mp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.721 -0.103 . . . . 63.119999999999997 110.721 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 51.32 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 70.409999999999997 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 52.219999999999999 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 62.149999999999999 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.340000000000003 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.129999999999995 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 61.240000000000002 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.439999999999998 111.341 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.400000000000006 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.45 HD21 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 65.200000000000003 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.575 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.430000000000007 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 65.219999999999999 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.219999999999999 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.412 HG12 HD22 ' A' ' 94' ' ' LEU . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 64.209999999999994 111.303 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 72.430000000000007 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.430000000000007 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.5 ' O ' HG23 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 62.030000000000001 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.531 HG21 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 73.319999999999993 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.439999999999998 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 65.420000000000002 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.53 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 73.299999999999997 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.349999999999994 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 72.209999999999994 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.310000000000002 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.430000000000007 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.099999999999994 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 71.430000000000007 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.404 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.400000000000006 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 43.420000000000002 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.53 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 72.530000000000001 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.439999999999998 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.49 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 72.209999999999994 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.340000000000003 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 74.340000000000003 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.340000000000003 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 53.549999999999997 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.501 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 65.109999999999999 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.340000000000003 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' HD21 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.409999999999997 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 55.43 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 73.319999999999993 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.230000000000004 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.129999999999995 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.464 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 62.140000000000001 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.019999999999996 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 63.130000000000003 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.430000000000007 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 52.009999999999998 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.464 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.420000000000002 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 61.009999999999998 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 63.450000000000003 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.419 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.510000000000005 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.119999999999997 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 65.540000000000006 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 74.230000000000004 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.430000000000007 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.409999999999997 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 73.349999999999994 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.41 ' HB ' HG11 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.230000000000004 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 64.040000000000006 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.420000000000002 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.402 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.329999999999998 111.192 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 52.100000000000001 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.039999999999999 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.46 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 72.219999999999999 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.6 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.200000000000003 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.404 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.209999999999994 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 73.430000000000007 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.129999999999995 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 73.109999999999999 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.340000000000003 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.439999999999998 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 63.140000000000001 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 52.310000000000002 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 52.210000000000001 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.140000000000001 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.6 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 54.509999999999998 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.420000000000002 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.439999999999998 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 45.409999999999997 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.519999999999996 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.531 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 71.230000000000004 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 73.219999999999999 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 52.439999999999998 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.450000000000003 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.299999999999997 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 71.439999999999998 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 53.130000000000003 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 71.219999999999999 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.420000000000002 110.404 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 121.115 0.483 . . . . 62.509999999999998 111.495 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.426 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.230000000000004 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 61.039999999999999 110.854 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.426 ' HB ' ' O ' ' A' ' 9' ' ' LYS . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 42.240000000000002 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 65.540000000000006 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 64.109999999999999 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.319999999999993 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 73.340000000000003 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 71.510000000000005 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.239999999999995 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 54.329999999999998 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 65.530000000000001 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.129999999999995 111.94 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.568 HG13 HG23 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 64.120000000000005 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.129999999999995 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.230000000000004 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.230000000000004 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 91' ' ' LYS . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 62.350000000000001 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.409999999999997 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.439999999999998 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 64.120000000000005 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 60.43 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 63.539999999999999 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.340000000000003 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 64.5 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 65.319999999999993 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.010000000000005 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.735 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 63.32 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 64.400000000000006 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.439999999999998 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.542 ' HB3' HG13 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 51.6 t30 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.120000000000005 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.450000000000003 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.568 HG23 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 65.0 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.329999999999998 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.200000000000003 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 72.430000000000007 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.572 HG13 HD12 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 51.240000000000002 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 72.120000000000005 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.426 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 63.5 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.0 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 55.539999999999999 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 54.509999999999998 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.129999999999995 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.559 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.310000000000002 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.209999999999994 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 51.210000000000001 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 72.010000000000005 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.140000000000001 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.559 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 61.43 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.439999999999998 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.433 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 55.450000000000003 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 60.409999999999997 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' HG23 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 63.549999999999997 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 73.230000000000004 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 65.239999999999995 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.109999999999999 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 54.219999999999999 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.420000000000002 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 61.340000000000003 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.299999999999997 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.542 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.349999999999994 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 62.299999999999997 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.742 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 51.009999999999998 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 35.420000000000002 112.083 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.735 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 74.120000000000005 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.453 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.329999999999998 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.340000000000003 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.707 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.409999999999997 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.742 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 62.229999999999997 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.510000000000005 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 73.25 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.010000000000005 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.444 ' HA ' HD12 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.450000000000003 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 70.329999999999998 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 70.510000000000005 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.510000000000005 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 65.230000000000004 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 63.340000000000003 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.150000000000006 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.668 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 63.009999999999998 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 72.329999999999998 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 74.120000000000005 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 65.030000000000001 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.486 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 71.329999999999998 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.219999999999999 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.409999999999997 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 61.109999999999999 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 72.540000000000006 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 . . . . . 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.340000000000003 111.265 173.919 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.2 mm . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.187 0.44 . . . . 73.239999999999995 112.187 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.349999999999994 111.578 173.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.310000000000002 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 70.109999999999999 112.158 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.430000000000007 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.219999999999999 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 54.25 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.010000000000005 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.219999999999999 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.540000000000006 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.409999999999997 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 94' ' ' LEU . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.539999999999999 111.57 174.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.219999999999999 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 53.43 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.420000000000002 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.530000000000001 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.409999999999997 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.430000000000007 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.450000000000003 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.439999999999998 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.240000000000002 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.530000000000001 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 62.310000000000002 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 61.020000000000003 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.510000000000005 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.109999999999999 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.420000000000002 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.439999999999998 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.474 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 63.210000000000001 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.540000000000006 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.564 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 63.25 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.401 ' N ' HD22 ' A' ' 40' ' ' ASN . 0.9 OUTLIER -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 51.310000000000002 110.041 173.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.446 HG23 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 65.540000000000006 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.430000000000007 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 72.420000000000002 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.150000000000006 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 64.25 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 74.430000000000007 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.540000000000006 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.420000000000002 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 73.420000000000002 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.549999999999997 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 62.409999999999997 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 72.120000000000005 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.409999999999997 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.140000000000001 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 60.350000000000001 111.991 172.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.467 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.019999999999996 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 62.219999999999999 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 63.039999999999999 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 54.310000000000002 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 53.109999999999999 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.239999999999995 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.409999999999997 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 64.349999999999994 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.439999999999998 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 41.439999999999998 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.5 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 65.519999999999996 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 71.109999999999999 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 71.109999999999999 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.420000000000002 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 65.310000000000002 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.129999999999995 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.677 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 71.450000000000003 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 51.32 111.871 176.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.474 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.209999999999994 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.200000000000003 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 62.0 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.736 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.299999999999997 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.736 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.099999999999994 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.520000000000003 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.564 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 63.210000000000001 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 55.310000000000002 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.340000000000003 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.521 HD12 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.230000000000004 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.230000000000004 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 73.450000000000003 110.819 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.521 ' HD2' HD12 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 53.130000000000003 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 64.340000000000003 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.049999999999997 111.794 173.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 71.120000000000005 112.699 -176.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 70.340000000000003 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.424 HD11 HG23 ' A' ' 19' ' ' ILE . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 44.140000000000001 110.651 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.129999999999995 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 72.409999999999997 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.540000000000006 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 65.409999999999997 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.039999999999999 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 61.310000000000002 109.729 174.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm . . . . . 0 CA--C 1.559 1.294 0 CA-C-O 120.972 0.415 . . . . 65.439999999999998 111.581 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.010000000000005 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 71.400000000000006 111.158 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.020000000000003 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 73.219999999999999 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.319999999999993 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 52.539999999999999 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 55.210000000000001 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.230000000000004 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 62.43 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 52.210000000000001 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.453 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.310000000000002 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 60.340000000000003 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.42 HD22 ' N ' ' A' ' 21' ' ' ASN . 0.8 OUTLIER -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.420000000000002 111.85 179.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.449 HG13 HG23 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.439999999999998 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.239999999999995 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.310000000000002 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 62.130000000000003 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 62.140000000000001 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 72.019999999999996 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.420000000000002 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.450000000000003 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.109999999999999 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.409 ' HE3' HD21 ' A' ' 32' ' ' ASN . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 61.0 111.538 175.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.409 HD21 ' HE3' ' A' ' 31' ' ' LYS . 35.2 m-80 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.329999999999998 110.588 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 73.530000000000001 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.400000000000006 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.239999999999995 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.219999999999999 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.019999999999996 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.532 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.150000000000006 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.010000000000005 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.723 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.099999999999994 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.449 HG23 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.420000000000002 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.119999999999997 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.723 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 71.129999999999995 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 73.299999999999997 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.573 HG11 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.019999999999996 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.0 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.464 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 44.539999999999999 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 54.229999999999997 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 70.150000000000006 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.010000000000005 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.439999999999998 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.497 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 71.129999999999995 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.030000000000001 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 54.399999999999999 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.310000000000002 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.319999999999993 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.497 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.430000000000007 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.310000000000002 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.019999999999996 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.140000000000001 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 55.100000000000001 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 67' ' ' THR . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.219999999999999 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 62.520000000000003 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.129999999999995 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 72.340000000000003 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.599 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 64.319999999999993 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.319999999999993 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.340000000000003 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 72.420000000000002 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.25 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.439999999999998 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.420000000000002 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 60.200000000000003 112.519 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.739 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.150000000000006 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 71.040000000000006 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.420000000000002 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 62.149999999999999 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.466 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 72.230000000000004 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.230000000000004 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.030000000000001 108.767 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.140000000000001 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 45.299999999999997 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.230000000000004 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.329999999999998 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.140000000000001 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.530000000000001 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.439999999999998 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.429 HG13 HG23 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 72.340000000000003 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 65.109999999999999 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 60.530000000000001 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.599 ' HB3' HD11 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 73.340000000000003 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.453 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 64.239999999999995 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 54.030000000000001 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.310000000000002 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.150000000000006 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 72.099999999999994 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.329999999999998 110.212 -177.286 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.499 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm . . . . . 0 CA--C 1.557 1.234 0 CA-C-O 120.968 0.413 . . . . 74.420000000000002 110.797 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 62.450000000000003 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.349999999999994 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.401 HG12 HG23 ' A' ' 52' ' ' ILE . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.019999999999996 111.794 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 53.140000000000001 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.319999999999993 113.413 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.329999999999998 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.329999999999998 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.439999999999998 111.456 -173.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.120000000000005 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.109999999999999 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.129999999999995 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.209999999999994 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.319999999999993 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.530000000000001 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.430000000000007 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.540000000000006 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.219999999999999 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.478 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.030000000000001 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 63.229999999999997 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.409999999999997 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.559 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 64.209999999999994 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.349999999999994 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 72.129999999999995 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.519999999999996 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 71.519999999999996 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HA ' HD13 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.310000000000002 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 54.25 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.040000000000006 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.010000000000005 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 71.530000000000001 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.559 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.409999999999997 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 65.099999999999994 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 63.509999999999998 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.310000000000002 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.509999999999998 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 71.140000000000001 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.120000000000005 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.635 HG11 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.420000000000002 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 73.430000000000007 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.310000000000002 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.149999999999999 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 70.129999999999995 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.540000000000006 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.401 HG23 HG12 ' A' ' 11' ' ' VAL . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.099999999999994 110.363 175.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.219999999999999 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.439999999999998 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.499 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.420000000000002 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.530000000000001 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 63.119999999999997 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.430000000000007 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 71.219999999999999 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.319999999999993 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' O ' HG23 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 71.519999999999996 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.633 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 73.519999999999996 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.401 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 53.3 t-80 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 70.530000000000001 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.420000000000002 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG11 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.200000000000003 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 52.329999999999998 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.409999999999997 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.109999999999999 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 73.099999999999994 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.130000000000003 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 73.120000000000005 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 72.140000000000001 111.343 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.319999999999993 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 53.109999999999999 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.530000000000001 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.694 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.239999999999995 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.694 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.540000000000006 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 73.540000000000006 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.587 HG22 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 73.530000000000001 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 65.200000000000003 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.587 ' H ' HG22 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 70.519999999999996 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.439999999999998 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.129999999999995 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 72.030000000000001 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 63.409999999999997 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 64.549999999999997 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.019999999999996 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.478 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.230000000000004 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.530000000000001 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 73.400000000000006 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 73.200000000000003 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.140000000000001 109.279 170.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 64.239999999999995 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 64.340000000000003 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 61.32 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.200000000000003 111.821 -178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 . . . . . 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.409999999999997 110.549 178.918 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 120.657 0.265 . . . . 62.039999999999999 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.510000000000005 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 64.409999999999997 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.400000000000006 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.510000000000005 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.519999999999996 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.219999999999999 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.420000000000002 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 71.109999999999999 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 54.340000000000003 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 74.209999999999994 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.340000000000003 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.439999999999998 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.209999999999994 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.129999999999995 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 71.329999999999998 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.498 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 62.439999999999998 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.430000000000007 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 71.129999999999995 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.140000000000001 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.522 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 60.450000000000003 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.140000000000001 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 70.150000000000006 111.509 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 70.450000000000003 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.319999999999993 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.019999999999996 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 70.239999999999995 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.540000000000006 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.239999999999995 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.230000000000004 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 54.240000000000002 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 22' ' ' VAL . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 64.310000000000002 111.111 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 62.350000000000001 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' HIS . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.010000000000005 112.271 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 73.099999999999994 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.575 HG13 HD12 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 71.129999999999995 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 44' ' ' ARG . 46.6 t-80 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.109999999999999 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 71.310000000000002 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 61.020000000000003 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.299999999999997 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.519999999999996 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 62.049999999999997 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 60.210000000000001 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.099999999999994 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.030000000000001 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 74.409999999999997 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.538 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.329999999999998 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.329999999999998 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 65.319999999999993 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.239999999999995 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.040000000000006 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.319999999999993 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.575 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.549999999999997 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.140000000000001 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 63.100000000000001 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 73.019999999999996 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.010000000000005 110.402 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.120000000000005 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 73.239999999999995 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 55.130000000000003 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 72.510000000000005 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.230000000000004 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.406 ' HE2' HG23 ' A' ' 82' ' ' ILE . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 64.409999999999997 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 73.140000000000001 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.547 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.430000000000007 111.701 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.530000000000001 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' ASN . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.340000000000003 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 74.150000000000006 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 71.510000000000005 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.411 ' N ' HD12 ' A' ' 82' ' ' ILE . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.209999999999994 109.821 -175.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 70.0 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.452 ' HA ' HD12 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.519999999999996 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 71.230000000000004 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.510000000000005 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.350000000000001 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.049999999999997 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 72.420000000000002 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.109999999999999 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.329999999999998 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.420000000000002 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 63.539999999999999 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.230000000000004 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 65.349999999999994 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.510000000000005 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 61.409999999999997 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.510000000000005 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 71.310000000000002 109.568 179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 112.463 0.542 . . . . 64.540000000000006 112.463 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.299999999999997 111.394 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 51.420000000000002 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 70.25 112.87 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 53.509999999999998 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 70.120000000000005 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.210000000000001 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.481 HD21 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.239999999999995 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.140000000000001 111.196 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.219999999999999 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.473 HD11 HD22 ' A' ' 45' ' ' LEU . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.129999999999995 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.509 HG23 HD13 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 72.329999999999998 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.340000000000003 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.230000000000004 112.075 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 55.240000000000002 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.040000000000006 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 53.130000000000003 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 63.399999999999999 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.587 HG21 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.049999999999997 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.400000000000006 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 74.120000000000005 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.462 HG11 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.520000000000003 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.099999999999994 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 63.200000000000003 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.399999999999999 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.109999999999999 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 70.549999999999997 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.019999999999996 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.519999999999996 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.510000000000005 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 62.039999999999999 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.462 ' CE2' HG11 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.430000000000007 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.010000000000005 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 55.310000000000002 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 53.219999999999999 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 72.109999999999999 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 61.329999999999998 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD22 HD11 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.310000000000002 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.524 HG11 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.409999999999997 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 60.409999999999997 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.409999999999997 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.140000000000001 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 64.040000000000006 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 42.200000000000003 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 54.310000000000002 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.340000000000003 112.655 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.420000000000002 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.430000000000007 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.129999999999995 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 52.100000000000001 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.418 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.040000000000006 111.096 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.230000000000004 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.340000000000003 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 64.209999999999994 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 51.009999999999998 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 74.310000000000002 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.140000000000001 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.400000000000006 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 71.420000000000002 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.53 ' H ' HD12 ' A' ' 68' ' ' ILE . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 64.340000000000003 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 63.109999999999999 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 63.43 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 61.310000000000002 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.409999999999997 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 64.510000000000005 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.409999999999997 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.543 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 55.119999999999997 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.647 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 61.409999999999997 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 62.119999999999997 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.400000000000006 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.451 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.310000000000002 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.451 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.140000000000001 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.439999999999998 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.54 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.450000000000003 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.624 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 54.439999999999998 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.441 ' H ' HG22 ' A' ' 82' ' ' ILE . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.129999999999995 113.265 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 51.530000000000001 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.624 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.530000000000001 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.030000000000001 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.420000000000002 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 64.049999999999997 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.424 HG11 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.120000000000005 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.587 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 72.219999999999999 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.428 ' NZ ' ' HB2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 52.219999999999999 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 50.210000000000001 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.509 HD13 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 61.32 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 71.129999999999995 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.481 HG12 HD21 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.430000000000007 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.120000000000005 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 54.229999999999997 112.39 -173.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.72 0.295 . . . . 65.450000000000003 110.777 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 51.25 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.420000000000002 112.569 -178.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.349999999999994 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 64.239999999999995 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 72.420000000000002 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.200000000000003 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.209999999999994 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.450000000000003 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.409999999999997 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.471 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 72.310000000000002 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HA ' HD21 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.450000000000003 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 65.230000000000004 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 70.439999999999998 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.407 HG13 HG23 ' A' ' 42' ' ' ILE . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 72.299999999999997 111.924 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 74.239999999999995 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.219999999999999 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.400000000000006 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.409999999999997 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.109999999999999 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 72.430000000000007 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 73.299999999999997 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.040000000000006 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.010000000000005 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.439 ' HA ' HG12 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 74.549999999999997 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.209999999999994 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.319999999999993 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.540000000000006 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 64.209999999999994 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.030000000000001 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 29' ' ' VAL . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.349999999999994 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 73.409999999999997 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.430000000000007 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.407 HG23 HG13 ' A' ' 22' ' ' VAL . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 71.099999999999994 112.024 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.099999999999994 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 64.409999999999997 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 71.040000000000006 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD12 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 62.310000000000002 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 43.310000000000002 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.471 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.209999999999994 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.149999999999999 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.456 ' HE3' ' HD2' ' A' ' 66' ' ' HIS . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 71.439999999999998 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 74.530000000000001 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 71.439999999999998 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.537 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 61.509999999999998 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 65.0 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.030000000000001 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.209999999999994 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 15.51 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.537 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.140000000000001 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.519999999999996 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.230000000000004 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 73.030000000000001 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.240000000000002 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.450000000000003 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 54.530000000000001 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.565 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.439999999999998 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.456 ' HD2' ' HE3' ' A' ' 50' ' ' LYS . 57.5 t-80 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 71.150000000000006 110.952 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 54.25 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.435 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.430000000000007 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 60.229999999999997 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.329999999999998 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.340000000000003 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 73.120000000000005 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.030000000000001 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.219999999999999 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 65.239999999999995 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.593 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.219999999999999 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.552 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.4 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.310000000000002 112.233 -178.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 63.32 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.735 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 62.32 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.735 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 71.420000000000002 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 71.209999999999994 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 82' ' ' ILE . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 62.32 109.432 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.519999999999996 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 73.219999999999999 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.310000000000002 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.444 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 70.150000000000006 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.409999999999997 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 53.109999999999999 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.420000000000002 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 72.409999999999997 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.310000000000002 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' HG23 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 64.319999999999993 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.129999999999995 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.230000000000004 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.420000000000002 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.109999999999999 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 71.420000000000002 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.439999999999998 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 . . . . . 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 65.409999999999997 110.917 178.518 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt . . . . . 0 CA--C 1.556 1.178 0 N-CA-C 111.639 0.237 . . . . 73.409999999999997 111.639 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 65.129999999999995 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 61.530000000000001 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.477 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 72.049999999999997 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.219999999999999 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.430000000000007 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 71.25 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.614 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 72.019999999999996 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.614 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 74.420000000000002 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.120000000000005 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 72.439999999999998 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.120000000000005 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 64.329999999999998 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 70.0 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.457 HG13 HG23 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.430000000000007 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.120000000000005 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.230000000000004 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 62.240000000000002 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.594 HG21 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.439999999999998 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 63.420000000000002 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.319999999999993 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.606 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 51.109999999999999 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.319999999999993 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 71.099999999999994 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.400000000000006 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 73.030000000000001 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.409999999999997 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.439999999999998 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.549999999999997 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.030000000000001 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.606 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.519999999999996 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.430000000000007 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.409999999999997 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.515 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 72.030000000000001 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.420000000000002 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 64.109999999999999 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.329999999999998 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.54 HG13 HD12 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 63.140000000000001 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 73.430000000000007 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.340000000000003 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 71.430000000000007 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.439999999999998 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 71.340000000000003 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 73.219999999999999 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 64.5 111.885 -178.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.530000000000001 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.219999999999999 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.310000000000002 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.239999999999995 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.412 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 72.439999999999998 111.46 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.439999999999998 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.099999999999994 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 51.43 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 70.549999999999997 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.129999999999995 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.54 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.140000000000001 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.329999999999998 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 63.219999999999999 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.468 HG21 HG21 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 32.32 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 40.149999999999999 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.340000000000003 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 60.520000000000003 110.762 -179.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.010000000000005 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 63.149999999999999 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.693 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 73.540000000000006 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.698 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 52.310000000000002 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.478 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.239999999999995 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.46 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 44.119999999999997 110.699 171.593 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 64.019999999999996 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 62.140000000000001 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.693 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.400000000000006 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 72.239999999999995 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.698 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.209999999999994 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.299999999999997 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.239999999999995 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.520000000000003 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.42 ' HG ' HD21 ' A' ' 71' ' ' LEU . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 63.119999999999997 111.454 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 51.130000000000003 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.530000000000001 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.439999999999998 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.422 HG13 HG23 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.120000000000005 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.594 ' HG2' HG21 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 72.040000000000006 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.109999999999999 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.530000000000001 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 73.530000000000001 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 65.450000000000003 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.010000000000005 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 55.130000000000003 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.450000000000003 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.239999999999995 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 . . . . . 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 55.219999999999999 111.702 -176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.557 HG23 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 120.933 0.397 . . . . 65.239999999999995 111.052 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 61.43 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 70.510000000000005 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.555 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.219999999999999 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.420000000000002 111.189 165.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.239999999999995 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 74.409999999999997 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 74.540000000000006 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.239999999999995 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.340000000000003 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.329999999999998 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.438 HG23 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.099999999999994 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 61.240000000000002 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 71.430000000000007 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.209999999999994 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 62.25 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.549999999999997 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.200000000000003 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.009999999999998 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.049999999999997 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.230000000000004 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.578 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.540000000000006 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 42.210000000000001 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.510000000000005 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 70.239999999999995 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 71.319999999999993 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HA ' HD12 ' A' ' 82' ' ' ILE . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.329999999999998 112.443 -173.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.109999999999999 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.019999999999996 111.984 -173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.492 ' HA ' HD22 ' A' ' 40' ' ' ASN . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 53.020000000000003 111.377 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 73.5 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.578 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.329999999999998 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.492 HD22 ' HA ' ' A' ' 37' ' ' GLU . 58.1 m-80 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.209999999999994 110.222 170.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.239999999999995 111.132 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.417 HG23 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 71.25 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.129999999999995 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.450000000000003 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.439999999999998 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.612 HG11 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.319999999999993 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 65.230000000000004 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.120000000000005 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 64.299999999999997 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.517 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 73.25 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.319999999999993 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' HG22 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.310000000000002 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 52.439999999999998 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 64.439999999999998 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 62.210000000000001 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.557 ' SD ' HG23 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 63.32 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 63.039999999999999 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.219999999999999 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 54.329999999999998 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.230000000000004 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.66 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 63.229999999999997 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.019999999999996 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.319999999999993 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 60.340000000000003 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 50.109999999999999 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 62.119999999999997 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.019999999999996 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.612 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 44.329999999999998 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.517 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.549999999999997 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.340000000000003 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 63.310000000000002 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 41.329999999999998 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 72.299999999999997 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 63.200000000000003 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.503 ' HB3' HD11 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 64.329999999999998 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 64.200000000000003 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 54.409999999999997 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.230000000000004 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.310000000000002 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 45.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 72.319999999999993 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.120000000000005 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 61.530000000000001 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.523 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 63.130000000000003 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.200000000000003 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.200000000000003 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 72.230000000000004 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 62.219999999999999 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 52.409999999999997 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 63.210000000000001 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.427 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.409999999999997 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.43 ' CB ' HD11 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.329999999999998 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HG ' HG23 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.230000000000004 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.030000000000001 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.510000000000005 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.140000000000001 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.209999999999994 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.427 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.540000000000006 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.66 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 . . . . . 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.239999999999995 110.874 174.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 121.052 0.453 . . . . 42.350000000000001 110.933 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 73.239999999999995 111.328 171.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 62.299999999999997 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 44.119999999999997 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 61.340000000000003 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.329999999999998 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.019999999999996 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.453 HD21 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.109999999999999 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 65.209999999999994 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.519999999999996 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 72.040000000000006 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.519999999999996 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.109999999999999 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.209999999999994 111.999 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.030000000000001 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.119999999999997 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.756 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.430000000000007 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.409999999999997 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.48 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.140000000000001 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.756 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.530000000000001 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.530000000000001 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.200000000000003 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 63.109999999999999 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 70.439999999999998 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.140000000000001 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 53.350000000000001 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 74.430000000000007 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.519999999999996 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.450000000000003 113.467 -170.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 64.129999999999995 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.140000000000001 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 63.210000000000001 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 64.109999999999999 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.530000000000001 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.430000000000007 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.040000000000006 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.299999999999997 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 71.540000000000006 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.019999999999996 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.219999999999999 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.525 ' HB ' HD21 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.420000000000002 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.120000000000005 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.420000000000002 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 70.340000000000003 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 70.019999999999996 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.310000000000002 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.439999999999998 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 71.299999999999997 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 64.129999999999995 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.109999999999999 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.430000000000007 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.109999999999999 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.520000000000003 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 64.150000000000006 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 62.25 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.510000000000005 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.420000000000002 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 71.420000000000002 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 74.329999999999998 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 60.030000000000001 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.453 ' H ' HD12 ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.450000000000003 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.412 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 73.140000000000001 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 50.420000000000002 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.319999999999993 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 72.239999999999995 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.039999999999999 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 62.100000000000001 111.747 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 51.509999999999998 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 52.310000000000002 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 61.020000000000003 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.602 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 64.540000000000006 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.602 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 64.450000000000003 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 64.219999999999999 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.475 HG21 ' HE1' ' A' ' 39' ' ' TRP . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 61.43 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.129999999999995 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 33.030000000000001 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.230000000000004 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.329999999999998 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.476 HD13 HG12 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.239999999999995 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.420000000000002 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.030000000000001 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.329999999999998 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.409999999999997 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 65.510000000000005 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.340000000000003 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.420000000000002 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 70.450000000000003 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.453 HG12 HD21 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.409999999999997 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 63.039999999999999 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.129999999999995 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.319999999999993 111.229 176.41 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.003 -0.046 . . . . 75.450000000000003 111.013 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.420000000000002 111.557 176.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.340000000000003 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 52.109999999999999 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.230000000000004 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 55.200000000000003 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.109999999999999 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 53.240000000000002 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 74.530000000000001 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.200000000000003 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.310000000000002 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' HD11 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 64.519999999999996 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 74.439999999999998 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.430000000000007 112.088 178.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.319999999999993 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.510000000000005 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 63.030000000000001 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.530000000000001 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.010000000000005 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.319999999999993 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 71.310000000000002 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.486 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.120000000000005 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.219999999999999 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 52.32 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 72.319999999999993 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.439999999999998 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.019999999999996 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.010000000000005 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.200000000000003 112.514 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.420000000000002 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.140000000000001 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.486 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.340000000000003 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.040000000000006 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.426 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 71.209999999999994 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 72.510000000000005 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 60.229999999999997 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 63.140000000000001 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.130000000000003 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.239999999999995 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 52.229999999999997 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.466 ' HB ' HD21 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.329999999999998 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.510000000000005 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.150000000000006 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 72.310000000000002 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 53.240000000000002 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.451 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 64.239999999999995 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 53.43 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.549999999999997 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.109999999999999 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 73.109999999999999 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.451 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.099999999999994 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.519999999999996 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.040000000000006 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.409999999999997 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 70.400000000000006 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 73.040000000000006 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 62.039999999999999 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 53.420000000000002 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.129999999999995 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.120000000000005 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.099999999999994 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.239999999999995 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.049999999999997 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.439999999999998 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.230000000000004 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.540000000000006 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG13 ' A' ' 80' ' ' ILE . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 53.539999999999999 112.321 172.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.319999999999993 111.905 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.120000000000005 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.58 HD22 ' HB2' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.299999999999997 111.692 -179.342 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 74.439999999999998 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.58 ' HB2' HD22 ' A' ' 77' ' ' ASN . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.310000000000002 111.265 172.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 74' ' ' LYS . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 71.129999999999995 110.644 -169.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 61.219999999999999 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.530000000000001 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.420000000000002 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.099999999999994 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.340000000000003 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.120000000000005 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 65.040000000000006 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.439999999999998 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.448 HG13 HG23 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 72.239999999999995 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 73.549999999999997 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 54.32 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.239999999999995 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 53.399999999999999 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 55.109999999999999 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . 0.463 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 62.039999999999999 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.150000000000006 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 62.030000000000001 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 71.439999999999998 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 . . . . . 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.688 0.28 . . . . 74.129999999999995 111.037 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 73.310000000000002 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 60.310000000000002 111.706 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.409999999999997 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 53.420000000000002 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.140000000000001 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.230000000000004 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 61.130000000000003 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.200000000000003 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.400000000000006 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.561 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.510000000000005 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 72.400000000000006 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 65.299999999999997 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 61.32 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.400000000000006 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.420000000000002 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.420000000000002 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.430000000000007 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.622 HG21 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 43.399999999999999 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 65.340000000000003 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.439999999999998 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.557 HG12 HD13 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.450000000000003 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 65.230000000000004 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.200000000000003 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.329999999999998 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 73.510000000000005 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.535 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 64.25 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.519999999999996 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.409999999999997 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 62.329999999999998 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.439999999999998 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.319999999999993 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.340000000000003 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 64.329999999999998 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.458 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.239999999999995 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.419 ' HB2' HG11 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 60.109999999999999 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.120000000000005 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 53.539999999999999 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.57 HG11 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 72.010000000000005 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.040000000000006 110.5 171.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.561 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.129999999999995 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 65.409999999999997 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.530000000000001 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 61.109999999999999 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.444 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.400000000000006 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.200000000000003 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 34.140000000000001 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.200000000000003 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.444 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 71.109999999999999 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.420000000000002 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 61.149999999999999 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 32.130000000000003 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 72.129999999999995 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 62.149999999999999 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 70.319999999999993 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.557 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.319999999999993 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.519999999999996 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.240000000000002 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.57 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.129999999999995 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 54.100000000000001 110.866 172.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.240000000000002 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.423 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 44.149999999999999 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.120000000000005 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.430000000000007 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 71.010000000000005 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.549 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.129999999999995 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 70.439999999999998 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.420000000000002 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.439999999999998 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.040000000000006 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.547 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 52.109999999999999 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 73.030000000000001 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.549 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 71.329999999999998 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.409999999999997 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.515 ' HA ' HD12 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.140000000000001 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.439999999999998 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.54 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.329999999999998 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.557 HD13 HG12 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 72.530000000000001 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.109999999999999 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.540000000000006 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 70.510000000000005 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.622 ' HG2' HG21 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.439999999999998 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 72.430000000000007 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.511 ' O ' HG23 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 52.439999999999998 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.44 HD22 HG12 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.450000000000003 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.406 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.340000000000003 111.73 170.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 70.140000000000001 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.099999999999994 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 61.329999999999998 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.406 ' NH2' ' HB3' ' A' ' 95' ' ' ASP . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 73.329999999999998 112.835 -175.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 60.340000000000003 111.352 175.08 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.778 0.323 . . . . 75.219999999999999 111.54 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 41.020000000000003 111.139 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.329999999999998 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 62.350000000000001 111.679 176.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.299999999999997 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.674 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 53.32 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.310000000000002 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 65.209999999999994 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 73.340000000000003 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 55.450000000000003 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 73.129999999999995 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 64.400000000000006 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.129999999999995 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.450000000000003 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.465 HG13 HG23 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 71.319999999999993 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.340000000000003 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.450000000000003 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.129999999999995 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.129999999999995 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 52.240000000000002 111.684 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.109999999999999 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 HD13 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.310000000000002 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.430000000000007 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 63.229999999999997 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.230000000000004 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.239999999999995 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 53.219999999999999 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 73.140000000000001 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.435 ' HE3' HD11 ' A' ' 82' ' ' ILE . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 62.140000000000001 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 54.439999999999998 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 73.329999999999998 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.474 ' CE2' HG11 ' A' ' 29' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.439999999999998 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.230000000000004 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.420000000000002 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.465 HG23 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 74.150000000000006 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.150000000000006 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 70.230000000000004 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 73.239999999999995 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.150000000000006 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.109999999999999 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.120000000000005 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.422 ' HB2' HD13 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 71.140000000000001 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 73.340000000000003 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 54.119999999999997 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 73.409999999999997 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 52.539999999999999 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 63.32 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.439999999999998 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 63.119999999999997 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.150000000000006 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.430000000000007 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.140000000000001 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.430000000000007 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.437 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.430000000000007 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 64.420000000000002 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.340000000000003 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 62.340000000000003 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 73.409999999999997 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.219999999999999 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.310000000000002 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 63.5 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 61.25 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.510000000000005 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.439999999999998 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 71.439999999999998 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 53.140000000000001 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 63.420000000000002 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.439999999999998 112.472 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 63.450000000000003 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.040000000000006 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.310000000000002 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.150000000000006 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 62.420000000000002 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 65.219999999999999 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 36' ' ' MET . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 72.0 110.135 -170.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.439999999999998 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 63.549999999999997 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.109999999999999 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 90' ' ' VAL . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 71.420000000000002 110.965 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.496 HD13 HG12 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.129999999999995 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.439999999999998 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 73.049999999999997 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 86' ' ' LEU . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 61.539999999999999 110.438 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 72.200000000000003 111.725 171.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 72.010000000000005 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 71.420000000000002 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.349999999999994 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.439999999999998 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.109999999999999 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.109999999999999 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 73.150000000000006 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.219999999999999 113.533 -176.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.420000000000002 110.185 176.333 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 N--CA 1.487 1.409 0 N-CA-C 112.014 0.375 . . . . 74.109999999999999 112.014 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 71.439999999999998 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.310000000000002 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.329999999999998 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.099999999999994 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.400000000000006 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.450000000000003 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 51.229999999999997 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.519999999999996 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.140000000000001 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.109999999999999 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.040000000000006 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.340000000000003 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 73.540000000000006 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.482 HG13 HG23 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 62.450000000000003 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 62.32 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 62.329999999999998 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.47 ' O ' HG23 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 72.430000000000007 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 73.329999999999998 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 70.439999999999998 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.099999999999994 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.552 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 63.509999999999998 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.219999999999999 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 62.25 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 61.409999999999997 110.352 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 29' ' ' VAL . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 54.219999999999999 114.723 -171.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.349999999999994 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 64.420000000000002 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.652 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.230000000000004 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 71.120000000000005 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.430000000000007 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.552 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 73.019999999999996 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.350000000000001 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.510000000000005 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.482 HG23 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 64.349999999999994 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 60.0 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 54.439999999999998 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.607 HG11 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.329999999999998 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 72.129999999999995 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 72.120000000000005 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 72.329999999999998 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 50.140000000000001 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.349999999999994 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 72.310000000000002 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.532 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.400000000000006 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.340000000000003 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 72.439999999999998 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 60.140000000000001 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.540000000000006 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.532 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.129999999999995 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.420000000000002 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 54.340000000000003 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.415 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 62.310000000000002 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.039999999999999 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 67' ' ' THR . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 64.209999999999994 111.992 175.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 54.25 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.230000000000004 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.450000000000003 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 63' ' ' LYS . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 62.119999999999997 110.511 175.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.607 ' HB ' HG11 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.319999999999993 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.411 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 73.049999999999997 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 52.409999999999997 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 74.420000000000002 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 63.210000000000001 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.530000000000001 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 64.299999999999997 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.422 ' HE2' HG23 ' A' ' 82' ' ' ILE . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 61.119999999999997 112.152 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.652 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 61.310000000000002 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.230000000000004 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.409999999999997 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.66 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 63.130000000000003 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 62.340000000000003 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.310000000000002 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 55.420000000000002 109.52 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.404 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 63.229999999999997 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 42.520000000000003 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.450000000000003 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.639 HD12 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 64.299999999999997 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.52 HD12 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 61.109999999999999 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 54.210000000000001 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.639 ' HD2' HD12 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 74.030000000000001 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.219999999999999 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.040000000000006 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 74.040000000000006 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 72.329999999999998 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 71.340000000000003 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.485 ' N ' HD12 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.129999999999995 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 43.119999999999997 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.120000000000005 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.109999999999999 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.409999999999997 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 . . . . . 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 61.43 110.633 176.001 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt . . . . . 0 CA--C 1.558 1.257 0 N-CA-C 111.863 0.32 . . . . 73.219999999999999 111.863 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 70.219999999999999 111.885 179.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.419 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 71.510000000000005 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 62.450000000000003 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.519999999999996 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.601 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 54.210000000000001 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.409999999999997 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 55.439999999999998 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 54.25 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.319999999999993 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.519999999999996 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.219999999999999 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 71.129999999999995 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.120000000000005 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.52 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.019999999999996 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 54.530000000000001 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.219999999999999 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.150000000000006 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.409999999999997 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 65.510000000000005 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 64.420000000000002 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 62.219999999999999 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.420000000000002 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 70.540000000000006 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.402 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 60.329999999999998 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.140000000000001 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 71.450000000000003 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 74.109999999999999 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.574 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.340000000000003 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 64.439999999999998 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.420000000000002 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.129999999999995 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.420000000000002 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.439999999999998 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.52 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 74.099999999999994 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.430000000000007 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.310000000000002 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 64.109999999999999 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 72.319999999999993 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.219999999999999 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.420000000000002 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.416 ' O ' HG22 ' A' ' 53' ' ' THR . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.230000000000004 110.601 173.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 74.409999999999997 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 61.039999999999999 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 72.209999999999994 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.229999999999997 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.319999999999993 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 53.25 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.150000000000006 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 41.520000000000003 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.209999999999994 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.329999999999998 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.329999999999998 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 64.230000000000004 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 60.149999999999999 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.219999999999999 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 51.409999999999997 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.239999999999995 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.120000000000005 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.140000000000001 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.400000000000006 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 64.25 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 71.120000000000005 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.452 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 71.209999999999994 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 70.010000000000005 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 54.409999999999997 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.239999999999995 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 71.299999999999997 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.109999999999999 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 35.420000000000002 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 34.009999999999998 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.713 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 71.239999999999995 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.713 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.210000000000001 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.150000000000006 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 ' HE1' ' A' ' 36' ' ' MET . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.430000000000007 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.491 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 62.329999999999998 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.109999999999999 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.109999999999999 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.299999999999997 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.427 HD13 HG12 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 70.329999999999998 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.219999999999999 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.476 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.329999999999998 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.409999999999997 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 70.519999999999996 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.400000000000006 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 62.149999999999999 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 65.349999999999994 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 64.209999999999994 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.310000000000002 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 64.420000000000002 110.475 175.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.420000000000002 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.030000000000001 109.798 171.729 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.554 0.216 . . . . 71.099999999999994 110.915 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.49 64.5 4.29 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 116.515 -0.311 . . . . 43.25 112.804 177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 79.3 p -151.99 150.09 29.61 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.719 0.808 . . . . 74.340000000000003 111.208 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 -83.26 106.72 15.27 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 123.099 0.56 . . . . 72.140000000000001 110.69 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -64.73 -30.6 71.62 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.642 0.777 . . . . 75.340000000000003 111.258 177.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -55.9 -34.76 65.85 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.949 0.9 . . . . 64.329999999999998 112.153 175.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -64.95 -50.65 65.58 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.919 0.488 . . . . 74.5 110.575 176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -58.24 -41.18 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 123.779 0.831 . . . . 75.109999999999999 111.442 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -53.66 -50.94 64.69 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.29 1.036 . . . . 60.200000000000003 111.933 174.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -61.76 -51.39 68.54 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.659 0.784 . . . . 73.519999999999996 111.388 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 70.8 t -57.7 -36.27 54.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 124.602 1.161 . . . . 73.010000000000005 112.468 -177.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 90.1 m -59.83 -51.99 67.38 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.068 0.547 . . . . 72.209999999999994 110.907 177.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -76.18 -30.97 58.25 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 113.548 0.944 . . . . 73.299999999999997 113.548 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -62.0 -29.93 70.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.233 0.613 . . . . 73.099999999999994 111.096 172.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 8.3 tt -63.78 -40.66 97.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.867 0.867 . . . . 75.0 111.07 173.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.84 -43.91 91.51 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 120.837 0.351 . . . . 73.209999999999994 111.09 177.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -60.07 -37.09 78.86 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.92 0.888 . . . . 74.140000000000001 111.378 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' A' ' 18' ' ' LEU . 6.3 tp -71.01 -42.1 70.01 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.108 -0.951 . . . . 54.530000000000001 110.395 -177.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.473 ' HA ' HD11 ' A' ' 94' ' ' LEU . 76.2 mt -59.44 -41.73 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.174 0 C-N-CA 123.727 0.811 . . . . 50.420000000000002 111.143 172.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 64.9 tp60 -61.73 -52.1 65.63 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.98 0.512 . . . . 63.539999999999999 111.036 177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.73 -47.72 81.64 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.557 0.743 . . . . 75.430000000000007 111.702 -179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 HG23 ' A' ' 42' ' ' ILE . 54.8 t -63.79 -46.77 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.15 0.58 . . . . 72.519999999999996 111.884 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 93.9 m-20 -64.39 -30.8 71.83 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 118.183 0.447 . . . . 65.439999999999998 111.795 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -71.01 -39.07 72.59 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.083 0.553 . . . . 52.420000000000002 111.819 173.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -64.9 -40.43 95.07 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.391 -0.822 . . . . 75.340000000000003 111.245 174.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.423 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 88.4 mt -63.53 -33.27 60.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.88 0.872 . . . . 51.5 110.671 177.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 63.4 mttp -57.85 -42.97 85.55 Favored 'General case' 0 N--CA 1.495 1.799 0 CA-C-O 121.473 0.654 . . . . 74.129999999999995 110.673 173.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -73.62 -24.12 59.98 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.125 -0.943 . . . . 73.340000000000003 112.43 178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.549 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 25.1 t -78.49 -34.11 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.389 0 CA-C-O 120.891 0.377 . . . . 73.530000000000001 111.697 171.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 41.3 mt-10 -61.71 -25.54 67.49 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.072 -1.018 . . . . 72.299999999999997 109.807 171.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -81.59 -47.96 12.38 Favored 'General case' 0 CA--C 1.566 1.568 0 CA-C-N 114.385 -1.28 . . . . 74.150000000000006 110.736 174.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -125.74 83.33 62.54 Favored Pre-proline 0 N--CA 1.499 2.024 0 C-N-CA 124.701 1.201 . . . . 72.109999999999999 109.956 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -52.2 -42.35 60.27 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.038 2.492 . . . . 62.409999999999997 114.571 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.451 ' HA ' HD13 ' A' ' 82' ' ' ILE . 38.7 mt-10 -85.51 16.21 3.99 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.85 0.86 . . . . 64.340000000000003 112.817 -175.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -79.64 95.71 5.99 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.461 0.648 . . . . 75.519999999999996 110.133 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 5.8 mmt -75.38 -22.98 57.06 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.814 0.845 . . . . 73.019999999999996 112.455 -174.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -66.16 -44.06 85.2 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.252 1.021 . . . . 63.009999999999998 110.74 175.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -68.54 -43.03 77.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.313 0.645 . . . . 72.329999999999998 111.415 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.549 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 13.8 m95 -65.29 -30.31 71.16 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 112.294 0.479 . . . . 75.439999999999998 112.294 175.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -58.75 -48.91 79.58 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.155 0.582 . . . . 64.129999999999995 110.247 172.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -59.85 -54.97 39.92 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 115.931 -0.577 . . . . 74.420000000000002 111.385 177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.489 HG23 HG13 ' A' ' 22' ' ' VAL . 98.2 mt -56.29 -42.87 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 124.18 0.992 . . . . 71.109999999999999 111.738 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -56.73 -48.57 77.48 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.526 0.73 . . . . 61.310000000000002 111.636 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -72.37 -30.43 64.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.222 1.009 . . . . 72.329999999999998 113.361 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 92.2 mt -76.15 -43.25 43.71 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.122 0.569 . . . . 74.230000000000004 110.591 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.662 HG11 ' HB ' ' A' ' 68' ' ' ILE . 51.1 t -64.67 -33.55 63.98 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.803 0.841 . . . . 74.120000000000005 111.348 173.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -56.17 -46.08 79.48 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.499 0.719 . . . . 74.25 110.782 171.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 62.9 m -62.87 -42.02 99.6 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.897 0.479 . . . . 74.409999999999997 111.252 177.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 53.6 mtt -60.12 -44.19 95.08 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.076 0.55 . . . . 71.010000000000005 111.371 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -60.96 -51.75 67.94 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.779 -1.1 . . . . 72.140000000000001 110.457 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -53.11 -44.88 67.98 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.022 0.929 . . . . 75.400000000000006 111.894 175.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.0 mt -56.7 -57.13 10.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.727 0.811 . . . . 54.25 111.894 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.427 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.6 t -68.77 -29.76 68.2 Favored 'General case' 0 CA--C 1.557 1.234 0 N-CA-C 112.614 0.598 . . . . 64.239999999999995 112.614 -176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -67.67 -39.97 84.47 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.977 0.511 . . . . 73.219999999999999 110.841 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 77.2 p -75.41 -21.09 58.5 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.213 0.605 . . . . 65.120000000000005 111.796 177.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -82.67 -18.93 39.26 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.187 0.595 . . . . 53.210000000000001 111.492 169.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.29 62.12 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 114.297 0.479 . . . . 74.109999999999999 114.297 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.427 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 65.7 m-85 -79.59 94.68 5.7 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.606 0.762 . . . . 64.439999999999998 111.713 -178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 20.1 m -70.83 -35.71 72.59 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.251 0.62 . . . . 73.299999999999997 112.193 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 46.7 t -63.76 -47.49 80.79 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.196 0.598 . . . . 70.409999999999997 111.44 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 100' ' ' GLU . 20.1 t -64.46 -49.6 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 109.658 -0.497 . . . . 64.420000000000002 109.658 176.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.08 -33.59 62.91 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.712 0.805 . . . . 74.439999999999998 112.788 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 67' ' ' THR . 87.5 tttt -60.16 -45.98 91.24 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.364 0.666 . . . . 74.0 111.382 176.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.2 t -59.61 -44.67 93.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.315 0.646 . . . . 63.32 111.328 179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.568 HD12 HG13 ' A' ' 46' ' ' VAL . 3.2 mm? -71.91 -31.93 66.88 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.085 0.554 . . . . 71.230000000000004 111.013 177.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -68.66 -29.66 68.18 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.536 0.734 . . . . 74.430000000000007 110.87 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 63' ' ' LYS . 29.8 p -68.97 -37.91 79.07 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 110.023 -0.362 . . . . 72.239999999999995 110.023 176.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.662 ' HB ' HG11 ' A' ' 46' ' ' VAL . 10.9 mm -67.12 -41.0 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.342 0.657 . . . . 72.129999999999995 110.695 -178.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.1 mmm -53.97 -52.87 59.34 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.683 0.793 . . . . 62.539999999999999 111.646 177.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -64.19 -41.64 97.0 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 115.545 -0.752 . . . . 55.530000000000001 111.313 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -61.78 -59.24 5.46 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.574 1.15 . . . . 71.340000000000003 110.826 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.6 t -66.68 -34.87 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 124.796 1.238 . . . . 64.319999999999993 112.472 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -53.91 -42.72 69.05 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.921 0.488 . . . . 54.409999999999997 110.781 173.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -75.19 -30.21 60.59 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.911 0.884 . . . . 73.420000000000002 112.444 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.2 mtt -59.62 -38.87 82.48 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.285 0.634 . . . . 74.299999999999997 111.89 175.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.611 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 8.2 mp -51.99 -29.05 19.01 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.235 0.828 . . . . 55.409999999999997 113.235 175.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.44 ' N ' HD22 ' A' ' 77' ' ' ASN . 0.0 OUTLIER -102.67 123.29 46.11 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.688 0.795 . . . . 72.340000000000003 109.396 -178.724 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.1 t -61.77 -15.22 39.43 Favored 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 124.965 1.306 . . . . 75.120000000000005 112.89 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -55.71 -42.62 75.54 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.607 1.163 . . . . 74.310000000000002 110.928 175.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 5.1 mp -89.67 -42.52 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.225 -0.898 . . . . 62.039999999999999 110.564 -177.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.3 tttt 69.37 154.95 0.12 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 124.797 1.239 . . . . 75.409999999999997 112.251 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.451 HD13 ' HA ' ' A' ' 34' ' ' GLU . 3.4 mp -100.32 103.03 14.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 C-N-CA 123.697 0.799 . . . . 72.150000000000006 109.676 -175.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.6 m -74.42 136.97 42.37 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 116.11 -0.496 . . . . 70.340000000000003 109.922 174.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 40.8 m -54.46 -46.11 73.27 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.625 0.77 . . . . 72.109999999999999 112.153 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -69.94 -29.74 66.95 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.002 0.921 . . . . 62.009999999999998 112.01 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 44.1 tp -66.84 -34.05 76.96 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.146 0.578 . . . . 63.520000000000003 111.152 177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.43 HD13 HG12 ' A' ' 29' ' ' VAL . 50.1 mt -60.23 -34.66 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 C-N-CA 123.226 0.61 . . . . 44.340000000000003 110.347 172.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -72.56 -28.85 63.08 Favored 'General case' 0 C--N 1.354 0.794 0 CA-C-N 115.581 -0.736 . . . . 64.219999999999999 110.995 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -67.4 -45.36 76.41 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 122.316 0.246 . . . . 73.040000000000006 110.507 173.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 52.2 t -54.66 -48.84 71.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 123.402 0.681 . . . . 72.530000000000001 110.726 174.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.38 -48.98 79.42 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.336 -1.302 . . . . 74.340000000000003 111.396 -178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -63.9 -41.01 97.8 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.276 1.03 . . . . 72.129999999999995 112.327 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -64.3 -38.87 92.56 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.057 0.943 . . . . 64.010000000000005 111.685 173.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.1 tm? -73.43 -34.95 65.7 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.458 0.703 . . . . 70.319999999999993 110.14 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.84 -41.75 92.08 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.9 1.28 . . . . 71.519999999999996 111.223 168.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.3 tpt -62.8 -27.99 69.69 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 114.557 -1.201 . . . . 61.420000000000002 112.214 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -58.57 -37.82 67.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 C-N-CA 122.909 0.484 . . . . 71.310000000000002 111.765 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.7 m -65.07 -46.98 78.92 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 121.4 0.619 . . . . 75.109999999999999 111.23 174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -70.85 -24.96 62.62 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.867 0.867 . . . . 70.319999999999993 111.991 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.708 ' HG3' HG22 ' A' ' 61' ' ' VAL . 9.0 tp10 -77.86 -34.41 51.76 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.821 0.849 . . . . 75.019999999999996 110.134 175.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 9.0 tt -65.85 -27.2 68.06 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.941 0.896 . . . . 71.439999999999998 110.957 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.42 -32.1 69.88 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.847 -0.533 . . . . 72.140000000000001 111.589 172.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -76.41 -15.91 59.83 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.313 0.645 . . . . 72.439999999999998 112.507 176.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -57.64 -32.99 67.81 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.184 0.994 . . . . 72.209999999999994 113.541 -172.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.7 m -69.79 -33.14 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 N-CA-C 112.429 0.529 . . . . 72.329999999999998 112.429 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -79.46 -65.49 0.99 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.105 0.562 . . . . 52.130000000000003 110.767 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 81.82 -2.03 84.55 Favored Glycine 0 N--CA 1.478 1.492 0 N-CA-C 114.336 0.494 . . . . 72.450000000000003 114.336 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 57.0 p -82.14 81.33 8.1 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.28 0.632 . . . . 73.25 110.679 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 77.5 m-85 -84.14 69.47 10.39 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.38 0.672 . . . . 62.43 111.477 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.2 mt 71.93 -33.01 0.26 Allowed 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 126.111 1.764 . . . . 74.209999999999994 114.947 175.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.6 m -63.66 137.83 97.2 Favored Pre-proline 0 CA--C 1.566 1.595 0 CA-C-N 118.652 0.66 . . . . 70.140000000000001 111.581 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_exo -54.31 -36.53 87.14 Favored 'Trans proline' 0 C--N 1.384 2.411 0 C-N-CA 123.524 2.816 . . . . 71.209999999999994 114.503 -177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.559 1.305 0 C-N-CA 123.471 0.709 . . . . 72.340000000000003 109.251 -176.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 120.641 0.258 . . . . 53.340000000000003 110.961 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.1 104.94 2.88 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 111.72 -0.552 . . . . 74.439999999999998 111.72 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -67.3 110.36 3.5 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.655 0.782 . . . . 74.109999999999999 112.056 -175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -73.57 108.44 6.42 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.016 0.526 . . . . 53.509999999999998 111.046 176.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -61.23 -28.6 69.28 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.525 1.13 . . . . 73.230000000000004 112.113 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -59.11 -46.8 87.39 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.016 0.926 . . . . 74.400000000000006 110.757 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.52 -47.32 79.27 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 116.103 -0.499 . . . . 74.340000000000003 110.926 175.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.7 mm -58.35 -46.68 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.654 0.781 . . . . 51.310000000000002 112.119 -174.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -72.17 -38.49 69.13 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 112.075 0.398 . . . . 63.530000000000001 112.075 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -67.36 -49.02 65.72 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.682 0.793 . . . . 75.239999999999995 111.514 -177.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.8 p -66.13 -22.87 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.718 0.807 . . . . 75.25 111.729 -175.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 34.6 m -61.61 -50.19 73.58 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.228 0.611 . . . . 72.109999999999999 110.375 170.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.59 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 49.4 m-20 -75.23 -28.72 60.03 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 113.126 0.787 . . . . 61.5 113.126 179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -59.34 -36.92 76.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.911 0.484 . . . . 70.420000000000002 110.363 170.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.433 ' O ' HG13 ' A' ' 19' ' ' ILE . 8.6 tt -61.29 -40.21 93.3 Favored 'General case' 0 CA--C 1.56 1.35 0 C-N-CA 123.829 0.851 . . . . 40.020000000000003 111.461 174.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.59 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.0 OUTLIER -63.48 -44.83 93.25 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-N 118.055 0.389 . . . . 73.430000000000007 111.355 176.343 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -57.73 -39.18 76.71 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.569 0.7 . . . . 53.450000000000003 110.817 173.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.9 tp -70.45 -35.89 73.61 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 114.798 -1.092 . . . . 53.100000000000001 111.915 -175.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 15' ' ' LEU . 78.0 mt -59.71 -42.41 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 109.713 -0.477 . . . . 73.530000000000001 109.713 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -60.89 -48.51 81.48 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.995 0.518 . . . . 73.319999999999993 111.701 176.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -59.03 -50.13 75.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.732 0.413 . . . . 71.129999999999995 111.872 178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 42' ' ' ILE . 42.5 t -59.54 -52.71 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 123.385 0.674 . . . . 72.219999999999999 111.56 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 5.5 m-20 -55.59 -43.26 75.86 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.202 0.601 . . . . 73.209999999999994 111.848 178.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.53 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 5.0 m-20 -63.46 -40.04 96.07 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.548 0.739 . . . . 64.439999999999998 112.454 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -65.08 -36.59 84.79 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.915 0.486 . . . . 72.150000000000006 111.125 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 22' ' ' VAL . 62.8 mt -69.29 -33.3 57.24 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.076 0 C-N-CA 122.949 0.499 . . . . 61.149999999999999 110.667 175.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 87.8 mttt -63.34 -33.5 75.66 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.224 0.61 . . . . 71.219999999999999 111.412 177.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mm-40 -72.31 -25.99 61.78 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.442 -0.799 . . . . 72.519999999999996 111.536 173.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.48 HG11 ' CE2' ' A' ' 39' ' ' TRP . 39.9 t -79.35 -35.73 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 122.718 0.407 . . . . 73.530000000000001 111.639 169.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -68.99 -21.48 64.14 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.243 -0.911 . . . . 63.149999999999999 111.387 -174.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -82.29 -42.67 18.51 Favored 'General case' 0 CA--C 1.564 1.5 0 C-N-CA 122.85 0.46 . . . . 73.439999999999998 110.836 169.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -129.19 80.6 72.19 Favored Pre-proline 0 N--CA 1.497 1.915 0 C-N-CA 124.387 1.075 . . . . 73.25 109.869 -176.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -49.32 -48.96 16.8 Favored 'Trans proline' 0 C--N 1.389 2.677 0 C-N-CA 124.027 3.151 . . . . 61.340000000000003 116.268 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -89.29 58.83 4.61 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.77 0.828 . . . . 71.319999999999993 111.836 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -121.54 105.41 10.44 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 108.944 -0.762 . . . . 43.43 108.944 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.654 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 1.3 mmt -78.09 -22.22 49.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 115.415 -0.811 . . . . 64.25 112.578 -173.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -69.75 -40.12 76.33 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.629 0.771 . . . . 73.25 111.239 174.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -71.64 -30.23 65.52 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 122.617 0.367 . . . . 72.150000000000006 111.905 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.601 ' HZ2' HG12 ' A' ' 87' ' ' ILE . 56.1 m95 -71.35 -29.87 65.5 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 111.961 0.356 . . . . 73.420000000000002 111.961 170.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -65.24 -39.2 92.39 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.935 0.894 . . . . 72.219999999999999 110.862 177.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.5 mmmp? -54.51 -54.42 41.34 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.998 0.919 . . . . 74.329999999999998 111.57 171.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.54 HG23 HG13 ' A' ' 22' ' ' VAL . 69.9 mt -59.66 -50.55 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 124.176 0.991 . . . . 73.349999999999994 111.823 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.439 ' HB2' HG11 ' A' ' 72' ' ' VAL . 52.9 t80 -53.67 -43.93 69.28 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.49 1.116 . . . . 73.319999999999993 112.574 -177.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -70.62 -36.88 73.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.466 0.707 . . . . 74.109999999999999 112.865 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.7 mt -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.633 0.373 . . . . 54.140000000000001 111.894 179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.709 HG11 ' HB ' ' A' ' 68' ' ' ILE . 75.4 t -72.22 -34.77 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.531 0.732 . . . . 70.540000000000006 110.789 175.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -54.51 -37.63 65.56 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.762 0.825 . . . . 74.030000000000001 111.146 168.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 86.3 m -74.24 -42.93 58.9 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 71.299999999999997 110.829 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.6 mtt -57.02 -44.86 83.26 Favored 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 123.411 0.684 . . . . 62.43 112.031 175.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -55.72 -51.16 68.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.603 -1.18 . . . . 71.430000000000007 110.16 175.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.04 -32.7 74.12 Favored 'General case' 0 CA--C 1.563 1.459 0 C-N-CA 123.372 0.669 . . . . 71.120000000000005 112.35 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -63.61 -55.96 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.548 0.739 . . . . 72.140000000000001 110.724 176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.425 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.7 t -68.03 -28.66 67.59 Favored 'General case' 0 CA--C 1.553 1.059 0 N-CA-C 112.247 0.462 . . . . 75.099999999999994 112.247 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 63.4 mt-10 -72.4 -39.59 67.84 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 122.084 -0.385 . . . . 73.010000000000005 111.932 175.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.5 t -73.37 -23.61 60.21 Favored 'General case' 0 N--CA 1.494 1.775 0 CA-C-N 118.131 0.423 . . . . 72.120000000000005 111.179 176.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 55.6 mtt -68.93 -39.28 79.69 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.241 0.616 . . . . 50.399999999999999 110.134 165.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 116.96 -5.76 18.05 Favored Glycine 0 N--CA 1.476 1.316 0 C-N-CA 123.344 0.497 . . . . 41.43 113.742 178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.425 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.8 m-85 -80.18 80.71 6.57 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.081 0.952 . . . . 72.140000000000001 111.952 -176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.1 m -66.43 -27.2 67.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.674 0.39 . . . . 75.420000000000002 111.497 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.0 m -62.14 -45.9 91.4 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.79 0.836 . . . . 72.120000000000005 111.848 176.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.2 t -67.45 -38.8 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 122.836 0.455 . . . . 55.520000000000003 110.483 175.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.82 -30.54 61.56 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.642 0.777 . . . . 73.25 112.806 177.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 67' ' ' THR . 14.4 mptt -54.66 -46.78 74.08 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 123.186 0.594 . . . . 73.329999999999998 111.91 171.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.9 t -61.03 -44.0 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 123.287 0.635 . . . . 43.450000000000003 111.2 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.15 -29.33 61.74 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 115.696 -0.684 . . . . 73.450000000000003 110.914 178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 -72.12 -28.84 63.53 Favored 'General case' 0 C--O 1.247 0.944 0 C-N-CA 123.295 0.638 . . . . 74.510000000000005 110.707 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 32.9 p -63.98 -39.74 94.82 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 109.36 -0.607 . . . . 71.140000000000001 109.36 174.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.709 ' HB ' HG11 ' A' ' 46' ' ' VAL . 9.9 mm -70.31 -41.18 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 O-C-N 123.843 0.715 . . . . 73.25 110.464 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 85.7 mmm -52.13 -52.17 53.31 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.525 0.73 . . . . 73.409999999999997 110.968 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -68.28 -41.52 80.88 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 115.347 -0.842 . . . . 74.310000000000002 111.407 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 67' ' ' THR . 6.3 tt -61.37 -52.04 66.28 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.547 1.139 . . . . 72.230000000000004 110.768 -175.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 43' ' ' TYR . 52.6 t -66.87 -43.42 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.138 -0.937 . . . . 72.349999999999994 110.902 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.68 -31.13 71.24 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.976 0.91 . . . . 72.420000000000002 112.278 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.68 -51.48 19.21 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.772 0.429 . . . . 72.430000000000007 110.942 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.582 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.1 mtm -65.88 -29.7 70.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.3 0.64 . . . . 54.43 111.732 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.654 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 15.3 tp -49.22 -41.57 37.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 125.534 1.534 . . . . 73.209999999999994 110.808 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -88.79 125.63 34.98 Favored 'General case' 0 CA--C 1.557 1.222 0 CA-C-N 113.176 -1.829 . . . . 74.040000000000006 109.155 179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.8 m -64.43 -6.51 7.38 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 113.73 1.011 . . . . 40.43 113.73 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.793 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.9 pt-20 -68.4 -24.86 64.81 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.024 0.929 . . . . 74.109999999999999 111.602 176.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.793 HG12 ' HG3' ' A' ' 79' ' ' GLU . 18.6 mm -107.98 -46.66 7.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 124.3 1.04 . . . . 71.030000000000001 111.312 -176.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.606 ' HD2' ' H ' ' A' ' 82' ' ' ILE . 0.1 OUTLIER 73.89 153.19 0.14 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 124.832 1.253 . . . . 71.230000000000004 111.69 177.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.606 ' H ' ' HD2' ' A' ' 81' ' ' LYS . 3.6 mp -86.64 119.6 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.885 0.874 . . . . 53.420000000000002 110.236 -171.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 87.8 m -95.32 124.36 39.32 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 123.362 0.414 . . . . 44.240000000000002 109.907 176.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 99.9 p -62.01 -39.8 93.48 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 113.151 0.796 . . . . 71.319999999999993 113.151 -174.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -73.02 -26.3 61.27 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.565 0.58 . . . . 73.400000000000006 112.565 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.436 HD23 ' SD ' ' A' ' 75' ' ' MET . 26.9 tp -69.23 -31.26 69.7 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.197 0.599 . . . . 71.430000000000007 111.043 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.601 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 45.0 mt -56.37 -33.24 37.73 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 C-N-CA 123.416 0.687 . . . . 71.230000000000004 111.103 172.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -70.55 -27.89 64.48 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.06 0.544 . . . . 74.019999999999996 111.826 177.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.1 tttt -64.14 -43.18 96.01 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.634 0.374 . . . . 64.420000000000002 110.554 172.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.402 HG13 HG23 ' A' ' 68' ' ' ILE . 42.1 t -57.92 -49.9 79.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 C-N-CA 123.703 0.801 . . . . 74.200000000000003 110.907 176.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -56.63 -42.86 79.58 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 114.979 -1.01 . . . . 71.239999999999995 112.366 175.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -65.35 -33.05 75.05 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.548 0.739 . . . . 51.020000000000003 112.249 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.1 mmtt -67.42 -39.3 85.47 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 116.107 -0.497 . . . . 73.239999999999995 111.808 174.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -71.68 -27.95 63.4 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 122.719 0.408 . . . . 65.329999999999998 111.754 174.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -61.68 -43.91 97.96 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.532 0.682 . . . . 73.530000000000001 109.884 167.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 17.0 ttt -64.89 -35.4 81.01 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 114.698 -1.137 . . . . 72.329999999999998 112.237 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 93' ' ' LYS . 39.8 t -60.88 -46.57 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 109.883 -0.414 . . . . 61.549999999999997 109.883 176.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 55.6 m -60.34 -41.05 92.8 Favored 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.816 0.847 . . . . 63.229999999999997 111.69 175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.8 mmt180 -66.02 -31.59 72.57 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.194 0.598 . . . . 72.510000000000005 112.499 175.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -76.27 -29.06 57.3 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.869 0.467 . . . . 64.0 110.294 177.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 104' ' ' LYS . 95.3 mt -71.97 -29.9 64.73 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.018 0.927 . . . . 74.540000000000006 111.7 174.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -57.42 -48.35 79.36 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.494 0.718 . . . . 74.299999999999997 110.226 171.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -63.78 -40.97 97.95 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.804 -1.089 . . . . 71.140000000000001 110.811 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 101' ' ' LEU . 25.9 mmtt -57.31 -36.0 70.54 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.442 1.097 . . . . 71.129999999999995 112.667 177.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 101' ' ' LEU . 65.4 t -73.25 -50.92 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 122.38 0.272 . . . . 74.439999999999998 110.827 175.072 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 58.0 m 67.04 118.73 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.979 1.312 . . . . 74.209999999999994 111.503 -172.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.03 39.12 8.15 Favored Glycine 0 N--CA 1.478 1.471 0 CA-C-N 116.436 -0.347 . . . . 53.450000000000003 112.588 -174.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.3 m -96.81 22.5 8.15 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.905 0.882 . . . . 75.329999999999998 111.676 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -59.58 108.4 0.72 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.337 1.055 . . . . 73.409999999999997 112.017 -176.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.0 mp -71.68 99.33 2.09 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.967 0.507 . . . . 63.140000000000001 110.563 178.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.1 m -70.5 143.95 90.93 Favored Pre-proline 0 CA--C 1.569 1.699 0 C-N-CA 123.436 0.694 . . . . 75.430000000000007 111.381 176.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.24 113.31 2.0 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 122.755 2.303 . . . . 71.310000000000002 113.406 -175.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 CA--C 1.564 1.5 0 C-N-CA 123.771 0.828 . . . . 74.310000000000002 111.562 179.691 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.4 mtp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 110.411 -0.218 . . . . 74.420000000000002 110.411 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.02 116.78 6.09 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-O 120.191 -0.227 . . . . 54.25 112.676 175.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.5 p -61.64 -31.01 71.09 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.718 0.807 . . . . 55.329999999999998 112.451 -179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -77.94 110.59 12.99 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.184 0.593 . . . . 73.540000000000006 109.984 174.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -64.45 -30.46 71.49 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.687 0.756 . . . . 73.140000000000001 109.987 170.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -50.32 -45.57 54.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 125.242 1.417 . . . . 54.350000000000001 111.985 168.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -71.07 -47.45 58.27 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 124.257 1.023 . . . . 55.020000000000003 111.357 176.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 46.9 mm -58.19 -40.39 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.819 0.848 . . . . 74.430000000000007 112.214 -177.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -55.28 -48.32 74.22 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.291 0.636 . . . . 71.299999999999997 111.057 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 59.6 mttp -62.03 -54.46 41.25 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 115.513 -0.767 . . . . 74.030000000000001 111.544 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.412 HG12 HG23 ' A' ' 52' ' ' ILE . 88.6 t -60.32 -35.1 60.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.764 1.226 . . . . 74.239999999999995 112.726 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -61.13 -47.78 84.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.178 0.591 . . . . 64.120000000000005 111.169 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.671 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 72.4 m-20 -72.99 -29.03 62.74 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 112.846 0.684 . . . . 72.340000000000003 112.846 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 39.3 mm-40 -56.98 -39.19 74.17 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.399 0.619 . . . . 73.019999999999996 110.71 173.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.414 HD22 ' HG ' ' A' ' 101' ' ' LEU . 7.8 tt -61.75 -32.91 73.19 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-N 114.784 -1.098 . . . . 61.030000000000001 112.18 176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.671 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 1.4 mptm? -65.13 -47.62 76.47 Favored 'General case' 0 N--CA 1.505 2.279 0 CA-C-N 118.163 0.438 . . . . 75.019999999999996 111.478 176.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.19 -34.53 73.74 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.517 0.727 . . . . 73.420000000000002 110.921 175.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -66.48 -47.4 73.18 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.695 -1.139 . . . . 72.099999999999994 111.093 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 80.4 mt -56.59 -54.14 32.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.096 0.958 . . . . 65.140000000000001 111.257 173.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.87 -47.4 77.41 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.278 1.031 . . . . 74.530000000000001 112.019 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -66.15 -42.04 89.57 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.644 -0.707 . . . . 71.310000000000002 111.268 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 46.8 t -59.01 -45.28 92.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 122.997 0.519 . . . . 61.340000000000003 111.583 174.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.495 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 51.8 m-80 -56.99 -47.39 80.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.331 0.253 . . . . 61.439999999999998 111.26 175.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -59.48 -41.64 90.24 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.939 0.718 . . . . 53.310000000000002 112.939 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -68.74 -38.8 80.43 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 123.136 0.574 . . . . 52.509999999999998 111.91 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 55.6 mt -64.4 -36.12 76.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.345 0.658 . . . . 74.450000000000003 111.364 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 92.0 mttt -54.02 -43.85 70.46 Favored 'General case' 0 N--CA 1.498 1.946 0 CA-C-O 121.369 0.604 . . . . 72.219999999999999 111.209 175.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -69.99 -31.26 68.86 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.334 -0.848 . . . . 73.430000000000007 112.147 179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.523 HG11 ' CE2' ' A' ' 39' ' ' TRP . 10.4 t -75.74 -30.63 21.67 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 CA-C-O 120.995 0.426 . . . . 61.329999999999998 111.497 173.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.83 -20.94 66.19 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 121.791 -0.568 . . . . 75.310000000000002 110.774 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -84.34 -48.95 9.18 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.185 0.994 . . . . 74.129999999999995 110.569 168.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -123.86 90.89 50.26 Favored Pre-proline 0 CA--C 1.56 1.336 0 C-N-CA 123.588 0.755 . . . . 71.519999999999996 110.89 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.11 -35.34 76.2 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.987 2.458 . . . . 71.150000000000006 113.672 -173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -86.71 9.11 19.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.24 1.016 . . . . 55.119999999999997 112.351 -176.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -73.79 92.06 1.99 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.283 0.563 . . . . 75.340000000000003 109.652 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.619 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.4 mmt -68.42 -37.25 80.13 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.371 -0.832 . . . . 75.329999999999998 111.943 -174.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -59.48 -41.76 90.51 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.646 0.778 . . . . 71.239999999999995 112.316 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -72.01 -22.83 61.36 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.446 0.536 . . . . 52.219999999999999 112.446 173.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.523 ' CE2' HG11 ' A' ' 29' ' ' VAL . 25.6 m95 -76.34 -30.48 57.67 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.925 0.713 . . . . 74.209999999999994 112.925 168.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -71.29 -31.86 67.96 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.514 0.597 . . . . 42.299999999999997 110.681 173.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.451 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.2 mmtt -51.53 -57.37 9.27 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.504 0.722 . . . . 73.200000000000003 110.049 170.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.8 mt -70.86 -36.33 63.75 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 CA-C-N 114.38 -1.282 . . . . 75.25 111.73 -175.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -61.02 -42.44 98.47 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.792 0.837 . . . . 72.400000000000006 111.593 -178.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 60.5 mtm180 -68.59 -36.9 79.35 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.657 0.783 . . . . 74.439999999999998 111.681 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 75.7 mt -68.81 -41.64 78.36 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.043 0.537 . . . . 60.229999999999997 111.437 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.601 HG11 ' HB ' ' A' ' 68' ' ' ILE . 69.4 t -68.63 -36.48 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.738 0.815 . . . . 74.010000000000005 111.215 178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -56.27 -43.51 78.87 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.503 0.721 . . . . 75.099999999999994 110.286 171.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 64.6 m -67.22 -39.36 86.26 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 115.036 -0.984 . . . . 62.119999999999997 111.684 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 65.5 mtt -61.46 -39.97 92.81 Favored 'General case' 0 N--CA 1.498 1.949 0 C-N-CA 122.995 0.518 . . . . 64.430000000000007 111.45 177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -61.7 -53.81 51.14 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.825 0.85 . . . . 75.239999999999995 111.037 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -67.78 -30.7 70.2 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.213 0.449 . . . . 74.109999999999999 112.213 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.412 HG23 HG12 ' A' ' 11' ' ' VAL . 13.7 mt -60.57 -54.11 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.901 0 C-N-CA 123.624 0.77 . . . . 53.130000000000003 111.475 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.509 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.2 t -68.79 -28.78 67.08 Favored 'General case' 0 CA--C 1.556 1.209 0 N-CA-C 111.93 0.344 . . . . 72.430000000000007 111.93 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -70.17 -37.19 75.11 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.075 0.55 . . . . 64.239999999999995 111.652 173.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 39.0 p -72.93 -22.67 60.69 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 122.742 0.417 . . . . 65.530000000000001 111.336 174.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.9 mtt -77.43 -28.54 52.59 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.327 0.651 . . . . 64.530000000000001 111.485 168.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 108.13 -5.68 34.17 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 123.07 0.367 . . . . 63.439999999999998 113.859 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.509 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 95.4 m-85 -82.86 77.09 9.65 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 123.644 0.777 . . . . 73.540000000000006 111.315 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.5 m -62.76 -27.54 69.35 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.336 0.654 . . . . 73.239999999999995 112.389 177.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 59.4 p -59.99 -42.3 93.91 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.515 1.126 . . . . 62.130000000000003 112.253 176.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.497 HG23 ' HB3' ' A' ' 58' ' ' PHE . 24.8 t -70.96 -39.79 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.94 0.496 . . . . 74.510000000000005 110.827 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.58 -33.8 70.35 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.146 0.579 . . . . 61.200000000000003 112.328 177.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.53 -41.49 96.33 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.118 0.567 . . . . 72.25 111.228 175.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 66.8 t -65.41 -41.19 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.157 0.583 . . . . 64.420000000000002 111.156 177.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 HG13 ' A' ' 46' ' ' VAL . 4.3 mm? -73.28 -28.43 62.11 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.985 0.514 . . . . 73.319999999999993 111.384 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -66.34 -28.58 68.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.467 0.707 . . . . 64.549999999999997 110.928 176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 19.0 p -71.46 -26.75 62.85 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-O 120.517 0.199 . . . . 35.109999999999999 110.603 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.601 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.3 mm -76.68 -34.28 23.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.44 -0.948 . . . . 63.039999999999999 108.44 -178.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 21.5 mtp -63.96 -46.82 82.95 Favored 'General case' 0 C--O 1.214 -0.798 0 CA-C-N 114.681 -1.145 . . . . 51.0 110.227 174.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -57.34 -43.26 83.24 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.152 0.581 . . . . 65.019999999999996 111.237 174.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.3 tt -63.87 -59.4 4.57 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 114.849 -1.069 . . . . 72.420000000000002 110.921 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.6 t -66.53 -28.98 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 124.035 0.934 . . . . 61.240000000000002 112.455 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.53 -42.28 98.58 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.141 0.576 . . . . 62.020000000000003 110.079 173.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' HB3' HG13 ' A' ' 80' ' ' ILE . 30.8 mmtm -70.71 -30.65 67.26 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.502 0.721 . . . . 64.310000000000002 112.05 174.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.457 ' HG2' HG13 ' A' ' 82' ' ' ILE . 23.2 mtt -61.92 -40.04 94.12 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.497 0.319 . . . . 63.240000000000002 111.442 174.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.619 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 25.2 tp -55.5 -30.74 61.2 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.979 0.912 . . . . 53.25 112.49 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.61 142.67 28.38 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.697 0.761 . . . . 75.230000000000004 111.907 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.8 m -73.45 -4.89 36.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.455 1.102 . . . . 63.539999999999999 113.245 -174.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.788 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.6 pt-20 -67.31 -28.01 67.64 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.665 0.786 . . . . 74.5 110.961 177.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.788 HG12 ' HG3' ' A' ' 79' ' ' GLU . 13.6 mm -101.67 -47.32 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.502 1.121 . . . . 74.239999999999995 110.518 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 81.8 tttt 61.77 14.0 5.84 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.644 1.178 . . . . 54.530000000000001 113.256 175.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.457 HG13 ' HG2' ' A' ' 75' ' ' MET . 4.7 mp 63.89 107.71 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.816 1.246 . . . . 74.200000000000003 111.654 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 75.5 p -85.14 68.81 10.66 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 113.102 0.778 . . . . 73.239999999999995 113.102 -171.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 33.9 t 51.2 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.475 1.51 . . . . 70.040000000000006 113.947 174.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.77 -15.22 63.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.116 1.366 . . . . 63.439999999999998 112.371 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -56.65 -33.24 66.16 Favored 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 113.477 0.917 . . . . 74.450000000000003 113.477 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.2 mt -60.89 -40.19 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-O 121.959 0.885 . . . . 60.43 110.159 174.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -70.06 -27.18 64.42 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.167 -1.378 . . . . 61.539999999999999 110.667 178.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -63.65 -44.9 92.49 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 109.74 -0.467 . . . . 73.109999999999999 109.74 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 31.1 t -59.9 -45.54 94.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.539 0.736 . . . . 74.209999999999994 110.679 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.5 ttpp -67.93 -36.97 81.08 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.2 -0.909 . . . . 72.239999999999995 111.446 -177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -69.84 -37.36 76.15 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.128 0.971 . . . . 62.240000000000002 111.744 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.8 mmtt -64.14 -43.3 95.66 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.958 -0.565 . . . . 71.409999999999997 110.609 173.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.56 -33.3 74.75 Favored 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 124.075 0.95 . . . . 73.450000000000003 110.888 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -60.82 -43.55 98.07 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.921 0.889 . . . . 72.109999999999999 110.496 170.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 16.6 tpt -67.24 -34.38 77.33 Favored 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.924 -1.034 . . . . 61.43 111.085 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 93' ' ' LYS . 93.9 t -63.59 -39.13 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 C-N-CA 123.242 0.617 . . . . 74.140000000000001 110.581 172.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.1 m -63.05 -45.47 92.08 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.56 0.744 . . . . 70.140000000000001 110.841 175.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -66.65 -38.43 86.88 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.12 0.968 . . . . 70.140000000000001 112.179 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.454 ' O ' ' HD2' ' A' ' 104' ' ' LYS . 0.7 OUTLIER -74.3 -37.73 63.55 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.484 -0.78 . . . . 53.329999999999998 110.116 -174.265 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.414 ' HG ' HD22 ' A' ' 15' ' ' LEU . 3.4 tm? -58.47 -50.74 72.63 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.305 0.642 . . . . 73.310000000000002 109.782 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.58 -28.94 66.02 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.031 0.932 . . . . 61.219999999999999 111.558 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -73.49 -28.38 61.89 Favored 'General case' 0 CA--C 1.563 1.454 0 C-N-CA 123.78 0.832 . . . . 43.340000000000003 111.964 178.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 100' ' ' GLU . 1.2 mptp? -67.27 -45.53 76.37 Favored 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 118.459 0.572 . . . . 72.420000000000002 109.933 167.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.2 t -64.74 -21.63 29.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 123.732 0.813 . . . . 70.099999999999994 111.82 -177.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 37.2 t -61.76 -30.86 71.07 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.422 0.689 . . . . 52.439999999999998 112.36 173.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 161.05 77.99 0.03 OUTLIER Glycine 0 CA--C 1.535 1.307 0 CA-C-O 120.195 -0.225 . . . . 62.329999999999998 112.977 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 28.4 t -103.53 115.36 30.38 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.303 0.641 . . . . 72.239999999999995 110.814 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -92.08 -11.32 36.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.206 0.602 . . . . 72.530000000000001 111.647 176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 57.63 74.2 0.43 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.841 1.257 . . . . 53.240000000000002 111.674 -176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.0 m -80.08 122.71 83.36 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 116.159 -0.473 . . . . 71.329999999999998 109.938 171.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -75.89 17.31 0.71 Allowed 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 123.077 2.518 . . . . 74.430000000000007 114.035 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 72.4 ttt180 . . . . . 0 CA--C 1.564 1.515 0 C-N-CA 123.945 0.898 . . . . 75.409999999999997 110.442 177.82 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 109.443 -0.577 . . . . 74.209999999999994 109.443 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.29 79.91 0.1 OUTLIER Glycine 0 N--CA 1.478 1.476 0 CA-C-O 120.05 -0.305 . . . . 65.349999999999994 112.969 178.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.522 ' HB3' HD11 ' A' ' 8' ' ' ILE . 23.8 t 64.16 -176.03 0.16 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.419 1.087 . . . . 44.030000000000001 112.357 179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -93.83 107.79 19.64 Favored 'General case' 0 N--CA 1.486 1.348 0 O-C-N 121.554 -0.717 . . . . 71.340000000000003 109.844 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -57.98 -41.65 83.41 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 113.365 0.876 . . . . 72.040000000000006 113.365 -172.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -62.56 -42.58 99.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.966 0.348 . . . . 65.230000000000004 111.647 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -59.38 -44.39 92.76 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.938 0.495 . . . . 72.040000000000006 110.651 174.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 3' ' ' SER . 90.8 mt -58.34 -45.77 89.37 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.744 0.818 . . . . 64.340000000000003 111.114 176.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -64.45 -42.66 95.83 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.965 0.906 . . . . 72.310000000000002 112.13 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.24 -48.97 71.41 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.799 0.44 . . . . 74.030000000000001 111.129 177.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.15 -31.84 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.207 1.003 . . . . 73.430000000000007 112.514 -178.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.677 HG23 HD21 ' A' ' 101' ' ' LEU . 18.3 m -56.49 -42.69 78.73 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.747 0.819 . . . . 73.409999999999997 110.63 170.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -77.11 -42.4 38.23 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-N 115.448 -0.797 . . . . 71.129999999999995 112.364 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.05 -24.51 67.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.386 1.074 . . . . 73.129999999999995 112.008 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.665 HD22 ' HG ' ' A' ' 101' ' ' LEU . 8.1 tt -52.29 -39.06 60.02 Favored 'General case' 0 CA--C 1.563 1.475 0 C-N-CA 124.28 1.032 . . . . 63.530000000000001 112.081 172.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -36.38 70.74 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 118.204 0.457 . . . . 74.409999999999997 111.973 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -57.49 -40.52 78.78 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-O 121.521 0.677 . . . . 60.340000000000003 111.016 170.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 9.8 tp -68.27 -47.94 66.35 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 114.611 -1.177 . . . . 60.450000000000003 111.064 -176.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 98.4 mt -55.93 -42.8 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 124.225 1.01 . . . . 74.019999999999996 111.723 173.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -56.89 -48.36 78.36 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.121 0.969 . . . . 72.450000000000003 112.065 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 58.6 m-80 -62.4 -45.75 91.73 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 123.245 0.34 . . . . 74.239999999999995 111.492 176.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 66.3 t -60.82 -37.92 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.003 0.521 . . . . 71.049999999999997 111.946 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -57.65 -44.62 85.8 Favored 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 118.229 0.468 . . . . 54.200000000000003 111.293 174.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -73.91 -40.64 63.0 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.306 0.642 . . . . 73.329999999999998 111.903 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.469 ' O ' HG23 ' A' ' 29' ' ' VAL . 31.2 m-20 -64.34 -44.1 92.53 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.926 0.49 . . . . 64.540000000000006 111.031 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.653 HG21 ' HG2' ' A' ' 91' ' ' LYS . 24.4 mt -55.07 -42.2 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.726 0.81 . . . . 72.420000000000002 111.006 171.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -64.02 -36.15 83.06 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.23 0.612 . . . . 75.319999999999993 111.474 -175.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -67.68 -28.11 67.41 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.461 -0.791 . . . . 70.439999999999998 111.546 173.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.556 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 11.9 t -78.43 -34.02 17.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 122.742 0.417 . . . . 63.340000000000003 111.484 174.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -61.71 -22.88 65.73 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.213 0.605 . . . . 54.409999999999997 110.636 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -85.37 -54.59 4.49 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.453 0.701 . . . . 64.299999999999997 111.35 164.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -116.76 91.78 36.06 Favored Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.818 0.847 . . . . 63.109999999999999 111.01 -171.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.93 -40.35 12.32 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.964 2.443 . . . . 74.129999999999995 114.523 -167.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -93.33 12.42 24.79 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 112.788 0.662 . . . . 62.200000000000003 112.788 -171.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -71.97 90.31 1.15 Allowed 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.565 0.698 . . . . 64.200000000000003 110.023 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.553 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 11.1 mmt -61.9 -28.17 69.33 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 114.944 -1.026 . . . . 74.319999999999993 112.278 -176.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.455 ' HA ' HD22 ' A' ' 40' ' ' ASN . 7.1 mp0 -61.58 -40.25 94.08 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.592 1.157 . . . . 73.200000000000003 111.797 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 -71.79 -30.57 65.68 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.856 -0.611 . . . . 73.099999999999994 111.33 174.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.556 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 51.3 m95 -73.61 -27.63 61.39 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 112.265 0.469 . . . . 74.519999999999996 112.265 171.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.455 HD22 ' HA ' ' A' ' 37' ' ' GLU . 54.7 m-80 -64.08 -43.88 94.09 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 118.428 0.558 . . . . 71.310000000000002 109.726 170.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 28.4 mmtp -52.1 -57.98 7.95 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.147 0.579 . . . . 71.049999999999997 111.323 172.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -65.72 -41.37 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 123.92 0.888 . . . . 54.409999999999997 111.834 -173.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -60.07 -49.03 79.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.137 0.575 . . . . 75.349999999999994 111.92 177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -70.6 -36.44 73.53 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.407 0.683 . . . . 73.510000000000005 112.373 -176.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 90.9 mt -69.93 -39.18 76.29 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.687 0.395 . . . . 64.310000000000002 111.197 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG13 HD12 ' A' ' 65' ' ' LEU . 41.1 t -68.61 -33.05 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 123.518 0.727 . . . . 70.219999999999999 111.459 174.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -58.94 -41.53 87.64 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.988 0.515 . . . . 62.5 110.15 172.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 52' ' ' ILE . 59.7 m -66.43 -42.89 87.04 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.382 -0.826 . . . . 62.509999999999998 110.482 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.4 mtt -59.05 -36.3 74.8 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 122.894 0.478 . . . . 74.120000000000005 111.836 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -68.59 -52.6 29.85 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 110.499 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -62.23 -29.94 70.74 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 122.795 0.438 . . . . 74.430000000000007 111.58 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 56' ' ' MET . 83.0 mt -60.18 -59.99 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.063 0.545 . . . . 73.049999999999997 110.604 171.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.515 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.5 t -65.76 -28.42 69.02 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 112.338 0.495 . . . . 71.109999999999999 112.338 -177.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -67.61 -40.23 84.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.061 0.545 . . . . 73.430000000000007 111.447 175.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.8 t -79.33 -21.76 45.45 Favored 'General case' 0 N--CA 1.493 1.704 0 CA-C-N 117.808 0.277 . . . . 72.439999999999998 111.521 176.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.466 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 25.7 mmt -70.43 -25.42 63.2 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.768 0.427 . . . . 74.219999999999999 110.813 170.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.02 5.74 54.58 Favored Glycine 0 C--N 1.35 1.352 0 CA-C-N 116.152 -0.476 . . . . 64.340000000000003 113.488 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.515 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 52.0 m-85 -87.09 96.54 10.33 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.594 0.757 . . . . 70.430000000000007 111.142 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.9 m -72.56 -42.53 64.54 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.164 0.586 . . . . 74.120000000000005 111.107 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 57.8 m -60.98 -43.3 99.02 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.638 0.775 . . . . 73.140000000000001 112.051 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.9 t -69.3 -40.04 79.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 122.803 0.441 . . . . 75.25 110.386 177.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.41 -34.06 68.51 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.872 0.469 . . . . 64.310000000000002 111.906 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.437 ' O ' HG23 ' A' ' 67' ' ' THR . 59.8 mtpt -69.18 -35.65 76.51 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.352 0.661 . . . . 70.409999999999997 112.241 176.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.01 -48.55 88.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-O 121.195 0.522 . . . . 62.340000000000003 110.188 174.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.553 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -69.58 -29.95 67.62 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.603 -0.726 . . . . 60.299999999999997 111.11 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -68.23 -28.91 67.65 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.767 0.827 . . . . 74.230000000000004 111.026 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.437 HG23 ' O ' ' A' ' 63' ' ' LYS . 36.2 p -70.95 -34.68 71.71 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 110.236 -0.283 . . . . 53.219999999999999 110.236 175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.552 ' HB ' HG11 ' A' ' 46' ' ' VAL . 7.9 mm -74.53 -34.46 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.42 0.688 . . . . 71.420000000000002 110.525 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.4 mmm -54.91 -53.05 60.52 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.396 -0.82 . . . . 65.049999999999997 110.493 171.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -64.98 -42.97 94.08 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.645 -0.707 . . . . 43.210000000000001 111.368 178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 67' ' ' THR . 3.3 tt -56.47 -57.71 11.17 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.658 1.183 . . . . 72.329999999999998 110.783 -175.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 56.8 t -73.49 -35.51 45.55 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.256 0 CA-C-N 114.884 -1.053 . . . . 72.150000000000006 112.48 -176.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -64.62 -30.77 71.8 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.608 0.363 . . . . 65.430000000000007 110.91 176.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HB3' HG13 ' A' ' 80' ' ' ILE . 48.1 mtmt -67.24 -46.64 73.16 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.181 0.593 . . . . 71.400000000000006 111.012 171.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.547 ' HE2' HG23 ' A' ' 82' ' ' ILE . 32.4 mtt -53.44 -38.8 63.87 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.107 0.963 . . . . 60.039999999999999 111.481 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.553 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 14.7 tp -54.42 -25.63 25.98 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 125.104 1.362 . . . . 72.340000000000003 112.833 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -97.39 148.69 22.92 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.39 1.076 . . . . 73.010000000000005 111.639 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 49.3 m -66.2 -18.06 65.12 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.552 1.141 . . . . 71.099999999999994 113.041 -176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.77 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.7 pt-20 -72.25 -20.88 61.46 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.276 0.631 . . . . 51.340000000000003 112.048 -178.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.77 HG12 ' HG3' ' A' ' 79' ' ' GLU . 26.0 mm -113.09 124.92 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 124.051 0.94 . . . . 74.129999999999995 111.013 -174.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -90.03 134.7 34.09 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.557 0.743 . . . . 70.209999999999994 110.639 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.547 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.1 mp -91.8 95.11 5.22 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 N-CA-C 108.552 -0.907 . . . . 62.039999999999999 108.552 179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.495 ' OG1' ' HB2' ' A' ' 86' ' ' LEU . 65.6 p -80.88 153.96 27.33 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.061 -0.518 . . . . 72.299999999999997 110.494 178.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 47.1 t -55.78 -41.57 74.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.534 0.733 . . . . 61.340000000000003 112.037 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.454 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 8.0 m-20 -76.89 -17.33 59.02 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.632 0.773 . . . . 74.25 113.067 176.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.495 ' HB2' ' OG1' ' A' ' 83' ' ' THR . 10.4 tp -74.67 -36.82 62.8 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 121.678 -0.639 . . . . 71.25 111.223 176.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.401 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 24.8 mt -61.21 -31.71 50.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 123.756 0.822 . . . . 62.299999999999997 109.651 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 23.6 t70 -66.1 -33.91 76.86 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 114.781 -1.1 . . . . 70.109999999999999 111.22 177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 2.2 ttmp? -66.18 -40.34 90.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.695 0.398 . . . . 53.409999999999997 110.783 176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.8 t -64.72 -43.44 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.504 0.721 . . . . 63.219999999999999 110.402 174.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.653 ' HG2' HG21 ' A' ' 26' ' ' ILE . 6.0 mmtp -57.54 -51.78 68.08 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.84 1.256 . . . . 60.049999999999997 111.909 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -63.72 -37.98 89.4 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.156 0.982 . . . . 73.530000000000001 112.35 -175.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.53 -28.58 56.39 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.432 0.693 . . . . 74.109999999999999 112.375 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -69.87 -37.41 76.07 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.769 0.827 . . . . 73.400000000000006 109.56 171.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -59.94 -41.15 91.21 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.912 0.885 . . . . 62.509999999999998 111.41 170.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 10.7 tpt -60.01 -34.72 73.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.687 1.195 . . . . 71.030000000000001 112.508 177.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.29 -43.19 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 122.834 0.454 . . . . 75.129999999999995 110.882 177.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 21.0 m -62.73 -45.77 91.19 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.533 0.733 . . . . 71.019999999999996 111.219 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -37.12 85.43 Favored 'General case' 0 CA--C 1.559 1.308 0 C-N-CA 123.716 0.806 . . . . 74.120000000000005 111.166 -176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' LYS . 20.3 tp10 -68.46 -39.11 81.56 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.591 0.756 . . . . 71.519999999999996 111.398 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.677 HD21 HG23 ' A' ' 12' ' ' THR . 1.8 tm? -72.54 -29.5 63.63 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.379 0.672 . . . . 63.109999999999999 110.816 178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -58.7 -38.57 78.55 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.775 0.83 . . . . 72.540000000000006 111.818 174.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.445 ' HD3' ' HA ' ' A' ' 100' ' ' GLU . 51.1 mtpt -61.25 -25.43 67.07 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.142 0.977 . . . . 71.230000000000004 112.935 -179.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.4 mmtt -62.63 -42.49 99.62 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.317 0.647 . . . . 73.099999999999994 112.227 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.3 t -91.03 -69.6 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 109.723 -0.473 . . . . 75.25 109.723 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t 60.78 -76.9 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.084 1.354 . . . . 73.510000000000005 112.415 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 127.33 -156.03 20.22 Favored Glycine 0 C--N 1.352 1.461 0 O-C-N 122.364 -0.21 . . . . 54.43 113.083 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 78.3 p -88.72 165.44 14.74 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 75.129999999999995 111.599 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 64.0 -75.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 124.852 1.261 . . . . 71.329999999999998 112.351 -178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 78.9 mt -75.1 91.28 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.248 0.547 . . . . 61.520000000000003 111.239 -178.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.2 m -129.28 147.25 64.26 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 124.335 1.054 . . . . 60.509999999999998 109.559 175.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_exo -55.83 135.55 70.15 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 122.611 2.207 . . . . 74.430000000000007 112.976 173.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? . . . . . 0 CA--C 1.568 1.64 0 C-N-CA 124.1 0.96 . . . . 73.5 112.828 -172.553 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 tpt . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 119.808 -0.139 . . . . 52.439999999999998 110.893 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 134.54 -9.96 4.64 Favored Glycine 0 C--N 1.355 1.593 0 CA-C-O 119.544 -0.587 . . . . 62.009999999999998 114.482 175.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.8 p -77.43 73.84 4.0 Favored 'General case' 0 N--CA 1.486 1.355 0 CA-C-O 121.895 0.855 . . . . 71.109999999999999 110.7 176.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.477 ' O ' HD13 ' A' ' 8' ' ' ILE . 30.3 t-80 -74.08 -39.38 63.47 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.029 -0.987 . . . . 74.239999999999995 111.005 -177.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -63.86 -31.47 72.66 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.978 0.511 . . . . 71.310000000000002 111.319 178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.71 -39.23 62.04 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.842 0.857 . . . . 74.519999999999996 111.25 172.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -56.45 -38.53 71.77 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.867 0.867 . . . . 74.150000000000006 111.503 174.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.477 HD13 ' O ' ' A' ' 4' ' ' HIS . 1.4 mp -54.0 -50.61 52.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 C-N-CA 123.978 0.911 . . . . 63.119999999999997 110.721 172.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -58.09 -42.56 85.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.843 0.857 . . . . 51.32 111.94 -178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.46 -51.5 59.68 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.488 -0.778 . . . . 70.409999999999997 111.866 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.4 m -74.56 -20.53 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.323 0.649 . . . . 52.219999999999999 112.679 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 46.8 m -59.79 -47.55 85.26 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.757 0.423 . . . . 62.149999999999999 110.036 170.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -74.54 -30.32 61.71 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 112.17 0.433 . . . . 73.340000000000003 112.17 179.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -57.92 -39.87 79.05 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.955 0.407 . . . . 74.129999999999995 110.648 168.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 12' ' ' THR . 5.4 tt -59.62 -34.39 72.71 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.944 0.898 . . . . 61.240000000000002 112.009 176.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HE2' ' HG ' ' A' ' 101' ' ' LEU . 0.7 OUTLIER -70.69 -42.81 70.18 Favored 'General case' 0 N--CA 1.503 2.223 0 CA-C-N 118.472 0.578 . . . . 72.439999999999998 111.341 175.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -58.25 -35.31 71.55 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.663 0.744 . . . . 74.400000000000006 110.877 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.45 HD21 ' HB ' ' A' ' 48' ' ' THR . 6.7 tp -76.32 -40.32 51.76 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 114.479 -1.237 . . . . 65.200000000000003 111.169 -177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.575 ' HA ' HD11 ' A' ' 94' ' ' LEU . 75.8 mt -57.16 -47.55 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.33 0.652 . . . . 73.430000000000007 110.043 171.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -53.35 -54.85 30.63 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.042 0.937 . . . . 65.219999999999999 111.846 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -61.33 -42.64 99.01 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.318 0.647 . . . . 75.219999999999999 112.041 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.412 HG12 HD22 ' A' ' 94' ' ' LEU . 81.9 t -65.83 -37.28 79.53 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 CA-C-O 119.174 -0.441 . . . . 64.209999999999994 111.303 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -57.14 -49.58 75.47 Favored 'General case' 0 N--CA 1.5 2.055 0 CA-C-N 118.554 0.615 . . . . 72.430000000000007 110.419 173.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.1 m-20 -63.29 -42.46 99.07 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.61 0.764 . . . . 75.430000000000007 112.663 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.5 ' O ' HG23 ' A' ' 29' ' ' VAL . 75.4 m-20 -64.23 -42.37 96.58 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.041 0.536 . . . . 62.030000000000001 111.605 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.531 HG21 ' HG2' ' A' ' 91' ' ' LYS . 85.4 mt -62.17 -40.14 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.308 0.643 . . . . 73.319999999999993 110.973 174.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 47.9 mtpt -57.34 -39.26 75.54 Favored 'General case' 0 N--CA 1.498 1.94 0 C-N-CA 123.402 0.681 . . . . 74.439999999999998 111.385 174.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -76.64 -24.52 53.33 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.231 0.613 . . . . 65.420000000000002 111.815 177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.53 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 75.3 t -72.91 -32.59 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 121.222 0.534 . . . . 73.299999999999997 110.87 168.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.7 mt-10 -68.52 -21.5 64.58 Favored 'General case' 0 CA--C 1.555 1.15 0 O-C-N 121.608 -0.682 . . . . 64.349999999999994 111.866 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -94.32 -27.12 16.27 Favored 'General case' 0 N--CA 1.493 1.675 0 C-N-CA 122.924 0.489 . . . . 72.209999999999994 111.511 167.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -134.61 75.7 62.51 Favored Pre-proline 0 N--CA 1.497 1.886 0 C-N-CA 124.321 1.048 . . . . 73.310000000000002 111.512 -177.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -65.12 -44.04 10.29 Favored 'Trans proline' 0 C--N 1.388 2.657 0 C-N-CA 123.128 2.552 . . . . 74.430000000000007 114.719 -172.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -85.52 -7.65 58.76 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.649 0.779 . . . . 74.099999999999994 112.677 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.96 91.97 1.6 Allowed 'General case' 0 CA--C 1.551 0.992 0 CA-C-O 121.952 0.882 . . . . 71.430000000000007 110.203 174.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.404 ' SD ' HD22 ' A' ' 76' ' ' LEU . 6.5 mmt -68.11 -18.58 64.68 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.369 1.248 . . . . 72.400000000000006 114.369 -170.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -53.05 -38.58 62.56 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-N 119.055 0.843 . . . . 43.420000000000002 112.741 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -72.14 -35.28 69.03 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.368 0.667 . . . . 75.25 112.384 174.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.53 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 54.4 m95 -74.27 -28.94 61.44 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 113.004 0.742 . . . . 72.530000000000001 113.004 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -67.17 -39.47 86.46 Favored 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 109.685 -0.487 . . . . 64.439999999999998 109.685 172.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.49 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 50.9 mtpt -58.22 -56.97 15.19 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.389 -0.823 . . . . 72.209999999999994 110.814 171.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 97.5 mt -60.83 -36.47 71.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 C-N-CA 123.604 0.761 . . . . 65.340000000000003 111.682 -176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -65.05 -39.86 93.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.875 0.47 . . . . 74.340000000000003 110.98 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 -70.8 -38.58 73.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.641 0.776 . . . . 73.340000000000003 112.441 174.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 85.6 mt -72.87 -39.78 66.19 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.05 0.54 . . . . 53.549999999999997 110.883 -176.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.501 HG13 HD12 ' A' ' 65' ' ' LEU . 71.1 t -72.86 -28.76 27.68 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.182 0 C-N-CA 123.602 0.761 . . . . 65.109999999999999 110.957 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -63.91 -35.73 81.64 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 122.861 0.465 . . . . 74.340000000000003 110.59 168.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.45 ' HB ' HD21 ' A' ' 18' ' ' LEU . 61.3 m -72.73 -38.27 67.5 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.051 0.54 . . . . 73.409999999999997 110.728 176.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.9 mtt -63.45 -44.12 95.41 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.283 0.633 . . . . 55.43 110.794 174.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -56.85 -45.4 82.44 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 125.031 1.332 . . . . 73.319999999999993 110.801 174.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.88 -42.39 94.86 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 114.9 -1.046 . . . . 73.230000000000004 111.981 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.417 ' O ' ' HG3' ' A' ' 56' ' ' MET . 50.4 mt -59.94 -53.89 42.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 C-N-CA 124.38 1.072 . . . . 75.129999999999995 110.994 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.464 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.7 t -66.69 -37.24 84.34 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 112.472 0.545 . . . . 62.140000000000001 112.472 -176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -71.52 -33.26 69.04 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 112.705 0.632 . . . . 75.019999999999996 112.705 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -77.92 -21.11 51.65 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 118.047 0.385 . . . . 63.130000000000003 111.369 173.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 52' ' ' ILE . 68.9 mtm -76.98 -24.0 52.26 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.768 0.427 . . . . 74.430000000000007 111.655 168.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.45 43.67 4.22 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-N 116.52 -0.309 . . . . 52.009999999999998 113.399 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.464 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 80.3 m-85 -126.83 95.63 4.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.304 1.041 . . . . 74.420000000000002 110.89 178.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 67.6 p -77.45 -29.15 52.66 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.245 0.618 . . . . 61.009999999999998 111.486 176.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 m -60.5 -44.09 96.36 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.985 0.914 . . . . 63.450000000000003 111.679 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.419 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 41.2 t -72.82 -42.11 61.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 CA-C-N 115.777 -0.647 . . . . 75.510000000000005 110.234 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.83 -33.4 68.59 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.576 0.751 . . . . 63.119999999999997 112.593 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -55.21 -44.47 75.4 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.17 0.988 . . . . 65.540000000000006 111.474 175.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.4 t -62.04 -54.99 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 115.47 -0.787 . . . . 74.230000000000004 110.833 179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 HG13 ' A' ' 46' ' ' VAL . 3.4 mm? -63.83 -30.11 71.24 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.598 0.759 . . . . 73.430000000000007 111.633 -178.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -63.22 -29.28 70.65 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 124.136 0.974 . . . . 72.409999999999997 111.582 178.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 30.7 p -75.2 -35.49 61.52 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-O 119.748 -0.168 . . . . 73.349999999999994 111.28 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.41 ' HB ' HG11 ' A' ' 46' ' ' VAL . 3.5 mp -70.84 -38.93 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 N-CA-C 109.754 -0.461 . . . . 75.230000000000004 109.754 177.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 65.2 mmm -51.55 -52.06 50.22 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.497 0.719 . . . . 64.040000000000006 111.169 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -64.46 -43.7 93.39 Favored 'General case' 0 CA--C 1.554 1.132 0 CA-C-N 115.114 -0.948 . . . . 65.420000000000002 111.534 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.402 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -59.54 -56.4 22.38 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.832 1.253 . . . . 74.329999999999998 111.192 -176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.7 t -63.17 -45.18 99.19 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.207 1.003 . . . . 52.100000000000001 111.589 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -55.43 -32.89 63.1 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.128 0.971 . . . . 62.039999999999999 112.346 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.46 ' HB3' HG21 ' A' ' 80' ' ' ILE . 51.7 mtmt -73.12 -40.56 64.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.245 0.618 . . . . 72.219999999999999 112.063 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.6 ' SD ' HD23 ' A' ' 86' ' ' LEU . 71.7 mtm -63.78 -30.05 71.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.202 0.445 . . . . 75.200000000000003 112.202 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.404 HD22 ' SD ' ' A' ' 36' ' ' MET . 3.7 mm? -48.41 -31.25 5.97 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 124.486 1.114 . . . . 74.209999999999994 112.315 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.38 134.12 47.3 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.582 0.753 . . . . 73.430000000000007 110.639 172.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 26.8 t -70.84 -6.06 35.14 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.691 1.196 . . . . 70.129999999999995 112.94 -174.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.54 -27.11 62.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.536 0.734 . . . . 73.109999999999999 110.827 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 74' ' ' LYS . 7.6 mm -98.08 -56.74 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.647 1.179 . . . . 75.340000000000003 108.743 171.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 82.0 tttt 68.22 160.36 0.17 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 125.44 1.496 . . . . 74.439999999999998 113.046 175.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -82.41 108.9 15.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.907 1.283 . . . . 63.140000000000001 109.24 -174.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 1.8 m -86.78 23.43 1.7 Allowed 'General case' 0 CA--C 1.569 1.692 0 N-CA-C 113.098 0.777 . . . . 52.310000000000002 113.098 -167.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 67.5 m 64.07 -71.1 0.07 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 124.954 1.302 . . . . 52.210000000000001 112.759 176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -64.75 -19.0 65.55 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.722 0.809 . . . . 45.140000000000001 111.824 172.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.6 HD23 ' SD ' ' A' ' 75' ' ' MET . 27.2 tp -69.89 -33.34 72.07 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 120.915 0.388 . . . . 54.509999999999998 111.922 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.5 mt -55.34 -32.88 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.372 0.669 . . . . 73.420000000000002 110.721 170.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.4 -28.44 66.17 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.937 0.895 . . . . 61.439999999999998 111.359 -179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.7 -40.89 79.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.738 0.415 . . . . 45.409999999999997 110.327 175.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.0 t -63.63 -43.21 98.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.766 0.794 . . . . 75.519999999999996 110.4 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.531 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -60.65 -50.53 73.13 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 125.398 1.479 . . . . 71.230000000000004 110.776 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 tptt -72.71 -36.81 67.91 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.407 -0.815 . . . . 73.219999999999999 112.251 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.447 ' O ' HG23 ' A' ' 97' ' ' VAL . 42.3 mmtm -58.1 -38.55 76.66 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.113 0.565 . . . . 52.439999999999998 111.763 172.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 19' ' ' ILE . 30.1 tp -70.02 -40.77 75.01 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.648 0.779 . . . . 73.450000000000003 111.594 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -58.22 -42.53 86.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.533 0.733 . . . . 73.299999999999997 110.927 171.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.2 ttt -59.78 -38.35 81.63 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.05 1.34 . . . . 71.439999999999998 112.298 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 93' ' ' LYS . 38.2 t -61.19 -41.65 90.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-O 121.209 0.528 . . . . 73.25 110.518 175.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 36.1 m -66.51 -49.94 64.89 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.514 -0.766 . . . . 53.130000000000003 111.078 177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 1.6 mmp_? -64.74 -27.91 69.23 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.058 0.943 . . . . 71.219999999999999 112.426 -177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -68.76 -37.42 79.36 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 123.056 0.542 . . . . 64.420000000000002 110.404 174.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.487 ' HG ' ' HE2' ' A' ' 16' ' ' LYS . 2.9 tm? -67.66 -34.93 77.91 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.678 0.791 . . . . 74.310000000000002 110.788 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -59.4 -48.94 79.73 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.632 0.373 . . . . 61.439999999999998 111.112 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -67.08 -31.97 72.83 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.638 0.375 . . . . 74.420000000000002 111.605 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.88 73.5 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 124.092 0.957 . . . . 61.100000000000001 110.523 -178.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.2 m -90.47 -45.06 14.92 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.45 0 C-N-CA 122.64 0.376 . . . . 71.540000000000006 111.792 176.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.1 m -161.98 -65.7 0.05 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.215 1.006 . . . . 73.040000000000006 110.717 -178.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.29 130.82 2.89 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-N 115.711 -0.677 . . . . 41.299999999999997 112.066 -175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 74.0 m -75.72 85.52 2.73 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 117.577 0.688 . . . . 70.019999999999996 109.899 172.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -73.27 -34.05 65.59 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 115.105 -0.952 . . . . 74.109999999999999 111.275 -178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 57.0 tp 67.58 116.97 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.234 1.414 . . . . 42.149999999999999 112.547 178.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 15.4 m -60.94 111.74 4.63 Favored Pre-proline 0 CA--C 1.571 1.757 0 C-N-CA 123.239 0.616 . . . . 73.109999999999999 111.002 173.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 12.3 Cg_exo -71.64 -8.9 24.08 Favored 'Trans proline' 0 C--N 1.379 2.168 0 C-N-CA 123.113 2.542 . . . . 62.240000000000002 114.522 -171.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 . . . . . 0 CA--C 1.572 1.794 0 CA-C-O 118.688 -0.672 . . . . 72.030000000000001 111.819 -175.405 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 120.312 0.101 . . . . 73.409999999999997 111.061 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.04 172.9 41.24 Favored Glycine 0 C--N 1.349 1.275 0 N-CA-C 113.655 0.222 . . . . 74.25 113.655 177.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.5 m -83.84 68.04 9.79 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.309 0.644 . . . . 62.43 111.375 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 24.0 m-70 -79.91 103.22 9.66 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.886 0.474 . . . . 71.340000000000003 109.824 170.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -64.44 -31.02 72.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.15 0.58 . . . . 73.239999999999995 111.968 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -62.58 -41.72 99.12 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.501 0.72 . . . . 63.219999999999999 110.076 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.443 ' O ' HG23 ' A' ' 11' ' ' VAL . 82.6 t80 -60.5 -46.8 88.78 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 115.067 -0.97 . . . . 75.409999999999997 111.13 175.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.8 mm -62.76 -36.43 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.444 0.698 . . . . 62.509999999999998 111.495 177.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' O ' ' HB ' ' A' ' 12' ' ' THR . 62.0 mtpt -71.88 -26.96 62.55 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.532 0.733 . . . . 74.5 111.905 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -73.1 -35.65 66.62 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.571 0.349 . . . . 73.230000000000004 110.908 170.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 7' ' ' TYR . 93.8 t -63.59 -26.8 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 C-N-CA 123.339 0.656 . . . . 61.039999999999999 110.854 175.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.622 HG23 HD21 ' A' ' 101' ' ' LEU . 71.1 m -54.25 -50.84 66.28 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.351 0.661 . . . . 42.240000000000002 110.788 167.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.99 -31.51 63.01 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.296 0.639 . . . . 65.540000000000006 112.113 -179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -63.21 -34.69 78.19 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 122.989 0.516 . . . . 64.109999999999999 110.44 173.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.44 -42.21 96.12 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.232 1.013 . . . . 73.319999999999993 111.147 174.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -62.3 -40.58 96.75 Favored 'General case' 0 N--CA 1.503 2.217 0 C-N-CA 123.269 0.628 . . . . 73.340000000000003 111.394 175.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -64.86 -40.35 95.0 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.362 1.065 . . . . 71.510000000000005 109.424 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.2 tp -68.64 -47.19 67.22 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.252 -1.34 . . . . 75.239999999999995 111.348 -177.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.62 -40.44 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 123.995 0.918 . . . . 54.329999999999998 111.237 176.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -50.95 71.27 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.2 0.6 . . . . 65.530000000000001 110.921 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.92 -51.51 69.73 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.698 -0.683 . . . . 74.129999999999995 111.94 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.568 HG13 HG23 ' A' ' 42' ' ' ILE . 61.2 t -58.46 -47.91 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 123.118 0.567 . . . . 64.120000000000005 111.607 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.429 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 83.7 m-20 -56.93 -45.23 82.89 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.307 0.643 . . . . 75.129999999999995 112.164 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -68.56 -34.57 76.06 Favored 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 112.595 0.591 . . . . 75.230000000000004 112.595 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.493 ' O ' HG23 ' A' ' 29' ' ' VAL . 14.0 m-20 -66.79 -35.1 79.3 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.088 0.555 . . . . 75.230000000000004 111.192 170.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 91' ' ' LYS . 93.2 mt -67.48 -37.31 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 123.435 0.694 . . . . 62.350000000000001 110.647 175.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 85.1 mttt -59.26 -38.16 79.4 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 121.472 0.653 . . . . 75.409999999999997 110.291 173.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 30.5 mm-40 -68.55 -30.95 69.85 Favored 'General case' 0 CA--C 1.554 1.133 0 CA-C-N 115.381 -0.827 . . . . 74.439999999999998 111.587 174.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 25' ' ' ASP . 94.2 t -74.32 -35.76 40.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 123.203 0.601 . . . . 64.120000000000005 111.914 176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -61.07 -27.83 68.63 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.872 -0.517 . . . . 60.43 111.536 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HE2' ' HA ' ' A' ' 28' ' ' GLU . 63.4 pttt -95.11 -30.75 13.89 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 123.392 0.677 . . . . 63.539999999999999 112.134 170.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -125.14 75.81 67.68 Favored Pre-proline 0 N--CA 1.505 2.307 0 C-N-CA 124.32 1.048 . . . . 74.340000000000003 111.065 -178.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -66.0 -47.43 3.61 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 122.916 2.411 . . . . 64.5 114.715 -172.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -82.24 -0.76 46.81 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 112.971 0.73 . . . . 65.319999999999993 112.971 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -73.01 94.21 1.85 Allowed 'General case' 0 CA--C 1.55 0.944 0 CA-C-O 122.173 0.987 . . . . 74.010000000000005 110.672 172.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.735 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 29.6 mmt -66.14 -22.4 66.38 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.241 -1.345 . . . . 63.32 112.771 -175.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -55.8 -45.21 78.3 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.77 0.828 . . . . 64.400000000000006 112.239 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -67.38 -42.18 83.78 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.564 0.745 . . . . 74.439999999999998 111.431 178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.542 ' HB3' HG13 ' A' ' 72' ' ' VAL . 55.8 m95 -67.04 -29.63 69.49 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.358 0.503 . . . . 75.0 112.358 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.482 ' O ' ' HG3' ' A' ' 44' ' ' ARG . 51.6 t30 -72.66 -40.51 66.28 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.182 0.593 . . . . 74.120000000000005 110.549 176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -51.59 -52.68 45.43 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.719 0.807 . . . . 74.450000000000003 110.687 171.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.568 HG23 HG13 ' A' ' 22' ' ' VAL . 92.8 mt -55.58 -51.18 60.88 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 124.654 1.181 . . . . 65.0 111.832 173.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.5 -50.39 73.91 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 124.341 1.057 . . . . 73.329999999999998 111.588 -172.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 40' ' ' ASN . 53.8 mtt-85 -52.64 -42.74 64.92 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.147 0.979 . . . . 75.200000000000003 111.836 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' O ' ' HG3' ' A' ' 49' ' ' MET . 62.5 mt -73.84 -34.71 64.64 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 114.88 -1.054 . . . . 72.430000000000007 111.027 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.572 HG13 HD12 ' A' ' 65' ' ' LEU . 90.7 t -70.62 -31.43 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.48 0.712 . . . . 51.240000000000002 111.466 177.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -53.13 -50.76 63.86 Favored 'General case' 0 N--CA 1.496 1.839 0 N-CA-C 109.658 -0.497 . . . . 72.120000000000005 109.658 168.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.426 ' HB ' HD21 ' A' ' 18' ' ' LEU . 29.6 m -62.28 -45.21 94.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.701 -1.136 . . . . 63.5 111.325 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 64.8 mtt -60.18 -44.78 94.79 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.347 0.659 . . . . 74.0 112.226 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -64.29 -49.37 72.08 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 123.659 0.599 . . . . 55.539999999999999 111.137 -177.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -66.78 -30.5 70.73 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 111.85 0.315 . . . . 54.509999999999998 111.85 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 54.8 mt -61.62 -54.76 30.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 C-N-CA 123.053 0.541 . . . . 73.129999999999995 110.838 171.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.559 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.1 t -68.56 -29.48 68.04 Favored 'General case' 0 N--CA 1.484 1.249 0 N-CA-C 112.486 0.55 . . . . 75.310000000000002 112.486 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.03 -43.14 79.43 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.109 0.564 . . . . 72.209999999999994 111.394 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 t -76.99 -21.22 55.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 122.319 -0.238 . . . . 51.210000000000001 111.615 178.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.1 mtt -75.87 -24.31 55.7 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.172 0.589 . . . . 72.010000000000005 111.169 169.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.37 5.71 60.29 Favored Glycine 0 N--CA 1.479 1.548 0 N-CA-C 113.92 0.328 . . . . 74.140000000000001 113.92 178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.559 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 1.1 m-85 -80.37 81.93 6.52 Favored 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 109.645 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.9 m -63.88 -37.8 88.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 122.9 0.48 . . . . 61.43 111.972 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.1 m -60.65 -42.06 96.23 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.539 0.736 . . . . 73.439999999999998 112.094 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 20.9 t -71.53 -39.66 70.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 122.65 0.38 . . . . 55.450000000000003 110.803 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.91 -38.43 67.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.113 0.565 . . . . 60.409999999999997 112.003 178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' HG23 ' A' ' 67' ' ' THR . 13.6 mptt -65.74 -35.92 82.1 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.649 0.78 . . . . 63.549999999999997 112.001 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 63.7 t -62.11 -46.36 96.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 122.847 0.459 . . . . 73.230000000000004 110.728 176.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.572 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -71.11 -33.89 70.57 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.227 0.611 . . . . 65.239999999999995 110.952 176.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -64.31 -28.43 69.7 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.93 0.892 . . . . 74.109999999999999 111.126 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 63' ' ' LYS . 31.4 p -68.86 -42.7 76.7 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 109.766 -0.457 . . . . 54.219999999999999 109.766 174.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.459 ' HB ' HG11 ' A' ' 46' ' ' VAL . 8.5 mm -64.96 -41.5 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 123.699 0.8 . . . . 74.5 110.481 -178.535 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 78.9 mmm -56.12 -52.95 62.48 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 124.408 1.083 . . . . 63.420000000000002 111.322 177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -63.15 -40.01 96.35 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.139 -0.937 . . . . 61.340000000000003 111.292 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 86' ' ' LEU . 6.2 tt -64.59 -57.52 8.88 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.538 -1.21 . . . . 74.299999999999997 111.362 -173.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.542 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.4 t -65.09 -32.33 57.81 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.645 0.778 . . . . 75.349999999999994 111.107 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -57.14 -44.52 83.45 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.033 0.933 . . . . 62.299999999999997 111.617 174.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.742 ' HB3' HG13 ' A' ' 80' ' ' ILE . 29.9 mtpp -76.76 -42.09 42.3 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.801 0.84 . . . . 51.009999999999998 112.744 -176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 30.5 mtm -68.9 -29.51 67.8 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.885 0.474 . . . . 35.420000000000002 112.083 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.735 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 0.4 OUTLIER -49.41 -46.62 47.75 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.398 1.079 . . . . 74.120000000000005 110.337 172.076 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.453 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 61.3 m-20 -86.22 160.41 19.19 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 113.773 -1.558 . . . . 74.329999999999998 111.775 -171.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 29.9 t -78.46 70.78 4.86 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 121.602 0.715 . . . . 73.340000000000003 110.638 175.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.707 ' HG3' HG12 ' A' ' 80' ' ' ILE . 7.6 pt-20 -149.09 -38.95 0.16 Allowed 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.298 1.039 . . . . 74.409999999999997 110.195 -178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.742 HG13 ' HB3' ' A' ' 74' ' ' LYS . 6.7 mm -123.48 129.21 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 123.649 0.78 . . . . 62.229999999999997 110.579 -174.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -87.9 148.72 24.48 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.126 0.57 . . . . 72.510000000000005 110.401 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 82' ' ' ILE . 3.3 mp -86.33 98.72 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.303 0.641 . . . . 73.25 109.698 -170.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 89.1 m -75.19 132.65 41.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.805 -0.634 . . . . 74.010000000000005 111.484 -177.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.444 ' HA ' HD12 ' A' ' 87' ' ' ILE . 35.4 t -60.07 -44.54 94.66 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.907 0.883 . . . . 73.450000000000003 112.727 -176.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -64.25 -36.44 84.09 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.062 0.545 . . . . 70.329999999999998 111.279 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.643 HD21 HD21 ' A' ' 71' ' ' LEU . 0.5 OUTLIER -65.48 -41.83 92.86 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.466 -0.788 . . . . 70.510000000000005 111.86 178.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.6 mt -52.0 -39.28 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.535 0.734 . . . . 74.510000000000005 110.96 168.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HA ' ' HD3' ' A' ' 91' ' ' LYS . 34.3 m-20 -71.94 -28.09 63.23 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.305 -0.407 . . . . 65.230000000000004 111.767 176.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 37.7 tptt -70.83 -35.9 72.68 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.496 -0.32 . . . . 63.340000000000003 110.227 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 86' ' ' LEU . 47.9 t -62.79 -41.86 94.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.73 0.812 . . . . 75.150000000000006 110.188 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.668 ' HD3' ' HA ' ' A' ' 88' ' ' ASP . 58.3 mtpt -57.71 -47.61 81.91 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.126 -0.943 . . . . 63.009999999999998 111.596 173.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -69.78 -36.36 75.66 Favored 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 112.655 0.613 . . . . 72.329999999999998 112.655 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -69.33 -38.43 78.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.616 0.367 . . . . 74.120000000000005 111.47 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 24.1 tp -71.14 -29.49 65.3 Favored 'General case' 0 CA--C 1.56 1.333 0 CA-C-O 121.517 0.675 . . . . 65.030000000000001 111.175 174.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.486 ' O ' ' HG2' ' A' ' 99' ' ' ARG . 2.3 t70 -64.16 -43.97 93.53 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.349 1.06 . . . . 71.329999999999998 109.434 175.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 46.5 tpp -58.76 -36.62 74.66 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.498 1.519 . . . . 75.219999999999999 112.578 175.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -59.22 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 CA-C-O 121.39 0.614 . . . . 73.409999999999997 110.672 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 77.4 m -67.78 -41.69 82.84 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-N 115.513 -0.767 . . . . 61.109999999999999 111.345 175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 95' ' ' ASP . 14.8 mmt180 -70.02 -31.7 69.49 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.72 0.408 . . . . 72.540000000000006 111.984 -175.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -61.47 -54.26 45.76 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.843 0.857 . . . . 75.340000000000003 111.265 173.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.622 HD21 HG23 ' A' ' 12' ' ' THR . 18.2 tp -70.12 -26.91 64.17 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-N 115.436 -0.802 . . . . 75.0 111.23 -177.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -62.82 -45.6 91.84 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.310000000000002 110.734 173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -56.77 -39.25 73.7 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.86 0.864 . . . . 75.439999999999998 111.256 174.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -65.87 -49.11 69.25 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.758 0.823 . . . . 73.329999999999998 112.342 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.21 -21.0 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 122.856 0.462 . . . . 53.340000000000003 111.859 -178.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.7 t -82.44 137.47 34.68 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.12 0.568 . . . . 54.140000000000001 110.748 176.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.73 82.88 0.21 Allowed Glycine 0 CA--C 1.534 1.271 0 N-CA-C 111.898 -0.481 . . . . 52.539999999999999 111.898 173.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.2 m -101.98 109.7 21.49 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.519 0.728 . . . . 73.219999999999999 110.878 -172.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -91.32 -68.82 0.77 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.963 0.505 . . . . 74.019999999999996 110.163 173.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.4 mp 63.57 113.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.817 1.247 . . . . 64.0 111.827 -176.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -59.58 147.56 77.09 Favored Pre-proline 0 CA--C 1.568 1.662 0 C-N-CA 123.671 0.788 . . . . 74.25 112.487 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.93 -29.55 40.94 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.663 2.242 . . . . 73.540000000000006 113.871 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? . . . . . 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 75.150000000000006 109.444 175.343 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.7 tpp . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 110.12 -0.326 . . . . 45.200000000000003 110.12 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -110.82 150.38 17.75 Favored Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.216 -0.354 . . . . 71.109999999999999 112.216 176.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 94.6 p -78.25 159.33 28.55 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.616 0.366 . . . . 71.510000000000005 110.753 176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.414 ' O ' HG12 ' A' ' 8' ' ' ILE . 80.9 m80 -62.32 -30.94 71.52 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.091 0.556 . . . . 63.409999999999997 111.543 173.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -63.41 -45.67 89.96 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.203 0.601 . . . . 74.519999999999996 111.195 172.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 17.3 tp10 -63.76 -37.41 87.25 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.944 0.898 . . . . 72.430000000000007 111.26 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.432 ' O ' HG23 ' A' ' 11' ' ' VAL . 71.8 t80 -60.89 -50.05 74.98 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.154 0.981 . . . . 74.150000000000006 110.762 174.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 4' ' ' HIS . 32.2 mm -60.27 -36.04 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.615 0.766 . . . . 73.239999999999995 112.187 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 53.9 mtpt -56.84 -39.16 73.75 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.961 0.504 . . . . 74.349999999999994 111.578 173.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.94 -43.41 62.36 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.417 0.687 . . . . 74.310000000000002 111.157 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 7' ' ' TYR . 88.3 t -61.49 -24.59 34.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 124.248 1.019 . . . . 70.109999999999999 112.158 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.4 m -58.99 -47.69 84.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.382 0.673 . . . . 70.430000000000007 110.731 172.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -72.58 -30.43 64.38 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.135 0.574 . . . . 75.219999999999999 111.972 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -60.29 -39.82 88.25 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.113 0.482 . . . . 54.25 110.828 172.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 tt -60.5 -36.32 78.04 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.697 1.199 . . . . 72.010000000000005 112.28 176.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -59.03 -49.5 77.65 Favored 'General case' 0 N--CA 1.501 2.097 0 C-N-CA 123.493 0.717 . . . . 75.219999999999999 111.64 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -68.28 -36.01 78.72 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.598 0.759 . . . . 71.540000000000006 111.37 -178.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 18' ' ' LEU . 2.5 tp -63.49 -53.94 44.11 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.573 -1.194 . . . . 73.409999999999997 110.642 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 94' ' ' LEU . 96.7 mt -59.12 -42.76 87.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.885 0.874 . . . . 62.539999999999999 111.57 174.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.99 -57.51 12.77 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.121 0.968 . . . . 53.219999999999999 112.506 -174.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -67.65 -50.3 58.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.771 0.428 . . . . 53.43 111.73 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.483 ' O ' HG13 ' A' ' 26' ' ' ILE . 41.7 t -52.17 -47.57 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 C-N-CA 123.416 0.686 . . . . 72.420000000000002 111.988 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -53.6 -48.88 68.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.664 0.786 . . . . 75.530000000000001 111.352 -177.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 31.7 t70 -72.38 -37.74 68.67 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 115.372 -0.831 . . . . 74.409999999999997 111.815 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.496 ' O ' HG23 ' A' ' 29' ' ' VAL . 12.2 m-20 -60.28 -40.92 92.15 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.602 0.761 . . . . 64.430000000000007 112.29 177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 22' ' ' VAL . 51.0 mt -63.68 -37.55 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 C-N-CA 123.02 0.528 . . . . 62.450000000000003 111.004 177.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 6.4 mtpm? -63.02 -39.42 94.7 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.611 0.764 . . . . 74.439999999999998 110.972 174.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -66.3 -26.82 67.5 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.858 0.863 . . . . 62.240000000000002 112.045 175.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CE2' ' A' ' 39' ' ' TRP . 22.0 t -74.66 -28.92 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.328 0 O-C-N 122.196 -0.315 . . . . 71.530000000000001 111.616 176.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -61.4 -29.61 70.03 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.507 -0.746 . . . . 62.310000000000002 112.261 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -91.58 -29.99 16.63 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.238 0.615 . . . . 61.020000000000003 111.611 171.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -124.82 76.41 65.52 Favored Pre-proline 0 N--CA 1.497 1.897 0 C-N-CA 124.047 0.939 . . . . 75.510000000000005 111.635 -178.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.04 -44.45 0.89 Allowed 'Trans proline' 0 C--N 1.381 2.254 0 C-N-CA 122.905 2.403 . . . . 72.109999999999999 114.249 -169.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -86.76 -6.34 58.85 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.295 0.638 . . . . 72.420000000000002 112.01 -173.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -71.18 86.33 0.77 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 121.722 0.772 . . . . 73.439999999999998 109.561 175.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.474 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.8 mmt -60.77 -27.0 67.65 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 114.461 -1.245 . . . . 63.210000000000001 113.094 -169.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -57.0 -37.39 71.61 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.462 1.105 . . . . 75.540000000000006 112.27 -179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -65.21 -42.82 93.13 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.973 0.509 . . . . 74.25 110.943 172.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.564 ' HE1' HG21 ' A' ' 82' ' ' ILE . 21.4 m95 -66.8 -27.94 67.98 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.472 0.545 . . . . 63.25 112.472 174.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.401 ' N ' HD22 ' A' ' 40' ' ' ASN . 0.9 OUTLIER -65.89 -41.75 91.12 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 118.289 0.495 . . . . 51.310000000000002 110.041 173.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -59.0 -56.59 20.33 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 110.568 174.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.446 HG23 HG13 ' A' ' 22' ' ' VAL . 84.5 mt -60.16 -43.71 93.7 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.848 0.859 . . . . 65.540000000000006 111.765 -176.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -63.54 -48.45 77.46 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.277 0.631 . . . . 75.430000000000007 112.031 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -71.55 -27.65 63.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 112.551 0.574 . . . . 72.420000000000002 112.551 -177.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 96.2 mt -77.08 -39.15 50.73 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 122.825 0.45 . . . . 74.150000000000006 111.178 174.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.7 t -70.36 -28.36 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 C-N-CA 123.451 0.7 . . . . 64.25 110.9 172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.408 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 51.8 t-80 -57.44 -41.01 79.67 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.78 0.832 . . . . 74.430000000000007 109.785 170.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.0 m -73.78 -38.17 64.74 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.238 -0.892 . . . . 71.540000000000006 111.988 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.48 -40.94 84.12 Favored 'General case' 0 N--CA 1.503 2.199 0 CA-C-O 121.436 0.636 . . . . 74.420000000000002 111.018 175.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -59.39 -50.99 71.81 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 114.321 -1.309 . . . . 73.420000000000002 110.648 173.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 47' ' ' HIS . 43.5 mt-10 -56.83 -39.74 74.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.43 0.692 . . . . 74.549999999999997 112.184 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 43.1 mt -60.93 -55.77 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 124.152 0.981 . . . . 62.409999999999997 111.547 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.4 t -66.02 -29.93 70.38 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.014 0.375 . . . . 72.120000000000005 112.014 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.72 -31.51 61.86 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 112.266 0.469 . . . . 73.409999999999997 112.266 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 31.2 p -77.21 -23.03 51.47 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 122.771 0.428 . . . . 53.140000000000001 110.805 173.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -82.46 -16.7 47.92 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.639 0.776 . . . . 60.350000000000001 111.991 172.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.71 14.2 60.0 Favored Glycine 0 CA--C 1.538 1.509 0 N-CA-C 114.264 0.466 . . . . 72.0 114.264 176.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.467 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 90.9 m-85 -91.08 100.42 13.27 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.895 0.878 . . . . 75.019999999999996 110.923 174.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 64.9 m -74.01 -41.65 61.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.612 0.365 . . . . 62.219999999999999 110.627 174.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 37.6 t -60.65 -41.58 95.28 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.995 0.918 . . . . 63.039999999999999 112.136 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 47.6 t -69.78 -39.0 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 122.727 0.411 . . . . 54.310000000000002 110.595 174.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.67 76.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 112.566 0.58 . . . . 53.109999999999999 112.566 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -59.63 -40.25 87.01 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.127 0.571 . . . . 72.239999999999995 111.492 174.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 96.7 t -58.83 -55.4 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 122.97 0.508 . . . . 70.409999999999997 110.662 176.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -64.35 -31.18 72.28 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.349 0.659 . . . . 64.349999999999994 111.87 -179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -65.53 -27.48 68.49 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.183 0.993 . . . . 65.439999999999998 110.816 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 39.9 p -73.39 -37.01 66.14 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 119.522 -0.275 . . . . 41.439999999999998 111.308 177.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.5 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.4 mp -66.57 -37.18 79.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 N-CA-C 109.745 -0.465 . . . . 65.519999999999996 109.745 175.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 82.9 mmm -53.76 -53.6 49.95 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.236 0.614 . . . . 71.109999999999999 110.61 173.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -60.14 -44.63 94.78 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.721 0.808 . . . . 71.109999999999999 112.022 177.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.8 tt -59.61 -58.38 8.83 Favored 'General case' 0 CA--C 1.558 1.275 0 C-N-CA 124.871 1.268 . . . . 74.420000000000002 110.502 -173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.5 t -70.51 -35.19 60.61 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.275 0 C-N-CA 124.431 1.092 . . . . 65.310000000000002 112.902 -179.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.53 -34.95 76.42 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 122.95 0.5 . . . . 75.129999999999995 110.508 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.677 ' HB3' HG13 ' A' ' 80' ' ' ILE . 51.2 mtmt -73.5 -39.09 65.1 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.982 -0.554 . . . . 71.450000000000003 111.588 174.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.3 mtt -55.81 -37.43 68.64 Favored 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 123.708 0.803 . . . . 51.32 111.871 176.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.474 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 2.2 tm? -52.89 -47.33 67.97 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.958 1.303 . . . . 71.209999999999994 110.744 175.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -66.71 155.3 38.44 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 124.37 1.068 . . . . 65.200000000000003 112.296 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 36.2 t -71.27 -11.34 60.86 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.533 0.733 . . . . 62.0 112.28 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.736 ' HG3' HG12 ' A' ' 80' ' ' ILE . 10.3 pt-20 -75.2 -18.26 60.18 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 122.999 0.519 . . . . 75.299999999999997 112.192 -174.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.736 HG12 ' HG3' ' A' ' 79' ' ' GLU . 16.3 mm -115.71 124.49 72.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.065 0.946 . . . . 73.099999999999994 111.177 -175.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -87.85 125.63 34.58 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.646 -0.872 . . . . 63.520000000000003 108.646 167.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.564 HG21 ' HE1' ' A' ' 39' ' ' TRP . 3.2 mp -81.11 92.63 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 121.758 0.789 . . . . 63.32 109.594 -171.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.421 ' O ' HG13 ' A' ' 87' ' ' ILE . 60.1 m -73.68 133.58 43.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.67 -1.15 . . . . 63.210000000000001 110.746 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.584 ' HA ' HD12 ' A' ' 87' ' ' ILE . 50.9 m -60.19 -34.48 73.67 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.412 0.685 . . . . 55.310000000000002 112.737 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.18 -34.17 77.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.088 0.555 . . . . 74.340000000000003 112.066 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.521 HD12 ' HD2' ' A' ' 89' ' ' LYS . 30.4 tp -73.5 -34.41 65.28 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 120.754 0.311 . . . . 74.230000000000004 110.739 177.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' A' ' 84' ' ' SER . 52.1 mt -61.49 -31.67 51.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.403 0.681 . . . . 74.230000000000004 109.836 171.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -69.91 -31.34 69.07 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.548 -0.751 . . . . 73.450000000000003 110.819 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.521 ' HD2' HD12 ' A' ' 86' ' ' LEU . 54.2 mttp -64.11 -45.16 89.85 Favored 'General case' 0 C--N 1.36 1.044 0 CA-C-N 116.581 -0.281 . . . . 53.130000000000003 110.307 173.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 17.6 t -59.6 -38.1 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 123.905 0.753 . . . . 64.340000000000003 111.084 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.1 mtmm -59.18 -49.04 79.38 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.912 0.485 . . . . 75.049999999999997 111.794 173.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -31.67 70.03 Favored 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 112.699 0.629 . . . . 71.120000000000005 112.699 -176.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.5 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.3 mmtt -60.71 -46.03 91.97 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.02 0.528 . . . . 70.340000000000003 110.602 171.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.424 HD11 HG23 ' A' ' 19' ' ' ILE . 3.4 tm? -68.47 -34.41 75.89 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 123.706 0.803 . . . . 44.140000000000001 110.651 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -58.54 -41.32 85.3 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.687 0.795 . . . . 73.129999999999995 111.129 172.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 25.3 ttp -68.3 -36.65 79.66 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-N 115.113 -0.949 . . . . 72.409999999999997 111.772 177.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 63.2 t -63.13 -38.17 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 CA-C-O 121.422 0.629 . . . . 74.540000000000006 110.764 172.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 29.7 m -71.8 -39.04 70.13 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.768 0.827 . . . . 65.409999999999997 111.058 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 99' ' ' ARG . 1.9 tmt_? -72.07 -28.07 63.09 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.567 0.747 . . . . 62.039999999999999 110.656 179.102 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.21 -41.95 80.4 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.281 0.563 . . . . 61.310000000000002 109.729 174.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.21 -47.82 84.35 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 114.97 -1.014 . . . . 75.510000000000005 111.219 173.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -54.04 -39.31 66.09 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.961 0.904 . . . . 65.439999999999998 111.851 177.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -67.37 -53.3 30.56 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.478 0.711 . . . . 75.430000000000007 111.846 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.92 -18.89 61.35 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 113.247 0.832 . . . . 64.420000000000002 113.247 -169.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 94.2 t -87.34 -37.95 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.243 0.617 . . . . 71.450000000000003 110.972 174.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 83.8 p -65.58 -27.47 68.45 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.574 0.35 . . . . 70.400000000000006 111.813 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -86.39 121.23 5.67 Favored Glycine 0 CA--C 1.537 1.433 0 N-CA-C 111.143 -0.783 . . . . 65.430000000000007 111.143 167.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 71.0 m -71.39 96.35 1.46 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 117.41 0.605 . . . . 72.400000000000006 112.383 -176.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -161.18 162.55 31.35 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.72 0.808 . . . . 75.120000000000005 110.14 171.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.3 tp 51.82 37.9 21.79 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 124.782 1.233 . . . . 72.5 112.011 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.429 ' HA ' ' HD3' ' A' ' 112' ' ' PRO . 23.7 m -62.01 134.54 94.38 Favored Pre-proline 0 CA--C 1.566 1.589 0 CA-C-N 115.393 -0.822 . . . . 71.430000000000007 111.736 -178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 111' ' ' VAL . 24.3 Cg_exo -65.64 -11.03 28.73 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.978 2.452 . . . . 42.299999999999997 114.679 -175.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? . . . . . 0 CA--C 1.561 1.392 0 C-N-CA 123.736 0.815 . . . . 73.120000000000005 110.728 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 mmt . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 110.825 -0.065 . . . . 74.209999999999994 110.825 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.02 72.18 1.63 Allowed Glycine 0 C--N 1.354 1.578 0 O-C-N 123.173 0.295 . . . . 64.409999999999997 113.055 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.1 m -68.17 114.5 6.72 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.906 0.882 . . . . 71.5 111.371 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 68.82 27.03 5.81 Favored 'General case' 0 CA--C 1.568 1.649 0 C-N-CA 124.157 0.983 . . . . 71.420000000000002 111.934 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -64.33 -39.89 94.81 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.635 0.774 . . . . 74.120000000000005 111.966 178.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -56.52 -31.74 64.41 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.192 0.997 . . . . 74.140000000000001 113.489 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -54.31 -47.14 72.77 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.4 0.68 . . . . 71.019999999999996 111.471 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.3 mm -59.66 -38.83 77.59 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 C-N-CA 123.951 0.9 . . . . 65.439999999999998 111.581 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -67.19 -48.4 68.03 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.683 0.793 . . . . 73.010000000000005 111.948 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -62.6 -51.63 66.57 Favored 'General case' 0 N--CA 1.493 1.725 0 C-N-CA 122.998 0.519 . . . . 71.400000000000006 111.158 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.42 -23.44 22.48 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 124.468 1.107 . . . . 62.020000000000003 113.31 -174.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.9 m -59.22 -49.41 77.95 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.639 0.376 . . . . 73.219999999999999 111.682 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -77.61 -37.37 50.36 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.813 0.445 . . . . 74.319999999999993 111.854 178.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -59.78 -25.09 64.63 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.443 0.697 . . . . 52.539999999999999 111.767 177.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -56.47 -51.89 66.75 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 124.1 0.96 . . . . 55.210000000000001 111.394 171.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -35.72 76.82 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 112.055 0.391 . . . . 72.230000000000004 112.055 177.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -56.49 -42.02 77.61 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.737 0.78 . . . . 62.43 111.06 173.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 18' ' ' LEU . 7.1 tp -72.96 -45.03 60.28 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.489 -1.232 . . . . 52.210000000000001 111.049 -176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.453 HG23 ' HB3' ' A' ' 94' ' ' LEU . 84.3 mt -57.7 -41.86 80.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.622 0.769 . . . . 63.310000000000002 110.756 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -58.81 -48.71 80.35 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.852 0.861 . . . . 60.340000000000003 111.699 178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.42 HD22 ' N ' ' A' ' 21' ' ' ASN . 0.8 OUTLIER -61.96 -29.22 70.09 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.112 0.565 . . . . 64.420000000000002 111.85 179.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.449 HG13 HG23 ' A' ' 42' ' ' ILE . 78.7 t -78.28 -43.06 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.421 0.689 . . . . 73.439999999999998 111.428 173.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 98.0 m-20 -62.18 -53.97 47.73 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.443 0.697 . . . . 74.239999999999995 111.857 -173.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 18.5 m-20 -58.05 -31.77 67.35 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.098 0.559 . . . . 73.310000000000002 112.222 177.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -73.89 -41.82 61.6 Favored 'General case' 0 CA--C 1.559 1.303 0 CA-C-N 115.505 -0.77 . . . . 62.130000000000003 110.744 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -61.13 -40.38 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.847 0.859 . . . . 62.140000000000001 110.873 175.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 90.4 mttt -51.46 -43.17 62.03 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.364 0.666 . . . . 72.019999999999996 111.374 177.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -78.67 -24.06 45.35 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 113.361 0.874 . . . . 72.420000000000002 113.361 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.3 t -69.14 -32.9 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 CA-C-N 119.06 0.846 . . . . 70.450000000000003 111.314 169.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -59.98 -34.78 73.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.669 0.747 . . . . 72.109999999999999 110.456 171.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.409 ' HE3' HD21 ' A' ' 32' ' ' ASN . 37.9 ttpt -76.7 -37.92 55.26 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 114.402 -1.272 . . . . 61.0 111.538 175.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.409 HD21 ' HE3' ' A' ' 31' ' ' LYS . 35.2 m-80 -136.83 86.25 21.97 Favored Pre-proline 0 N--CA 1.496 1.849 0 C-N-CA 124.353 1.061 . . . . 74.329999999999998 110.588 -176.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.33 27.32 0.45 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 123.512 2.808 . . . . 73.530000000000001 115.324 -172.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -131.87 -21.34 2.44 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.387 0.884 . . . . 63.43 113.387 178.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -60.93 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.281 0 CA-C-O 121.546 0.688 . . . . 64.400000000000006 111.425 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.739 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 16.0 mmt -70.13 -24.4 63.17 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.084 -0.962 . . . . 74.239999999999995 112.718 -177.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -55.26 -43.16 74.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.157 0.583 . . . . 60.219999999999999 111.533 173.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -56.68 -51.5 68.51 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.722 0.809 . . . . 73.019999999999996 110.705 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.532 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 10.7 m95 -64.77 -28.81 69.83 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 113.707 1.003 . . . . 73.150000000000006 113.707 179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.26 -47.81 66.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.195 0.598 . . . . 75.010000000000005 110.625 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.723 ' HG2' HH21 ' A' ' 44' ' ' ARG . 10.2 mtmp? -60.23 -53.09 61.87 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 114.583 -1.189 . . . . 75.099999999999994 111.497 176.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.449 HG23 HG13 ' A' ' 22' ' ' VAL . 95.5 mt -54.76 -43.75 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 124.287 1.035 . . . . 71.420000000000002 111.91 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -60.62 -43.48 97.46 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.324 0.65 . . . . 63.119999999999997 111.623 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.723 HH21 ' HG2' ' A' ' 41' ' ' LYS . 49.1 mtm105 -70.6 -32.77 70.25 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 71.129999999999995 112.497 -179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 87.5 mt -72.4 -42.62 64.94 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.666 0.386 . . . . 73.299999999999997 111.082 177.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.573 HG11 ' HB ' ' A' ' 68' ' ' ILE . 93.6 t -71.15 -27.94 31.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 123.321 0.648 . . . . 74.019999999999996 111.19 175.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -46.63 79.44 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.565 0.746 . . . . 72.0 109.991 166.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.464 ' HB ' HD21 ' A' ' 18' ' ' LEU . 35.9 m -67.77 -37.07 81.6 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.915 -1.039 . . . . 44.539999999999999 110.954 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 59.1 mtt -65.7 -36.41 83.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.058 0.543 . . . . 54.229999999999997 111.83 175.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -66.64 -50.02 64.31 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.558 0.536 . . . . 70.150000000000006 110.54 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -67.17 -29.09 68.69 Favored 'General case' 0 CA--C 1.557 1.227 0 N-CA-C 111.927 0.343 . . . . 74.010000000000005 111.927 176.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.9 mt -57.87 -54.23 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.578 0.751 . . . . 72.439999999999998 110.828 171.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.497 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -70.18 -29.25 66.07 Favored 'General case' 0 CA--C 1.556 1.173 0 N-CA-C 112.215 0.45 . . . . 71.129999999999995 112.215 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.95 -41.42 91.29 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.063 0.545 . . . . 75.030000000000001 111.636 175.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.8 t -74.58 -25.26 59.16 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-O 120.653 0.263 . . . . 54.399999999999999 111.465 178.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.3 mmt -69.51 -22.86 63.56 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.04 0.536 . . . . 74.310000000000002 111.385 169.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.81 10.37 58.93 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 116.211 -0.449 . . . . 64.319999999999993 113.257 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.497 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 32.0 m-85 -93.77 72.19 4.2 Favored 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 123.739 0.815 . . . . 75.430000000000007 110.671 178.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -66.18 -31.19 71.87 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.742 0.417 . . . . 72.310000000000002 112.04 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.1 t -65.4 -37.42 86.91 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 122.874 0.47 . . . . 71.019999999999996 111.158 176.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 59.1 t -72.77 -33.19 43.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.985 0.514 . . . . 74.140000000000001 110.663 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.5 -33.57 69.97 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.27 0.47 . . . . 55.100000000000001 112.27 175.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 67' ' ' THR . 9.0 mtpm? -65.35 -33.97 77.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.916 0.486 . . . . 74.219999999999999 111.748 174.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.4 t -64.43 -48.77 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.798 0.439 . . . . 62.520000000000003 110.418 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.68 -32.64 74.09 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.153 0.581 . . . . 62.32 111.198 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -65.14 -26.26 68.1 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 124.107 0.963 . . . . 72.129999999999995 111.205 177.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 26.4 p -65.98 -30.4 70.96 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-O 119.453 -0.308 . . . . 72.340000000000003 111.821 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.599 HD11 ' HB3' ' A' ' 93' ' ' LYS . 3.9 mp -75.01 -39.9 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 N-CA-C 108.268 -1.012 . . . . 64.319999999999993 108.268 178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 16.7 mtp -63.85 -41.66 97.74 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 114.88 -1.054 . . . . 71.319999999999993 111.037 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.6 -53.32 56.44 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.744 0.817 . . . . 73.340000000000003 110.382 172.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.2 tt -53.55 -57.97 8.82 Favored 'General case' 0 CA--C 1.562 1.431 0 C-N-CA 124.689 1.196 . . . . 72.420000000000002 111.646 -175.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -65.18 -31.98 56.25 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.357 0 C-N-CA 124.516 1.127 . . . . 71.25 112.766 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -55.08 -39.13 68.95 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.064 0.546 . . . . 73.439999999999998 111.154 174.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HB3' HG13 ' A' ' 80' ' ' ILE . 3.7 mptp? -76.53 -39.43 52.94 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 122.918 0.487 . . . . 75.420000000000002 111.238 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.0 mtt -53.94 -37.44 63.87 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 124.011 0.925 . . . . 60.200000000000003 112.519 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.739 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 23.8 tp -49.31 -43.2 43.24 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.626 1.17 . . . . 75.150000000000006 112.412 -177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -90.22 148.63 22.81 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 114.27 -1.332 . . . . 71.040000000000006 111.379 -166.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.7 m -71.45 0.46 8.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.629 0.772 . . . . 73.420000000000002 112.575 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -78.88 -24.27 44.35 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.661 1.184 . . . . 62.149999999999999 110.752 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.466 HG13 ' HB3' ' A' ' 74' ' ' LYS . 25.9 mm -120.12 131.89 71.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.329 1.052 . . . . 72.230000000000004 110.469 -173.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -85.74 130.72 34.49 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.894 0.478 . . . . 75.230000000000004 110.644 173.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.2 mp -81.4 85.68 1.59 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 108.767 -0.827 . . . . 73.030000000000001 108.767 177.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 89.3 m -68.22 141.73 55.86 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 115.051 -0.977 . . . . 72.140000000000001 111.093 -177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 90.4 p -55.47 -46.19 76.88 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 45.299999999999997 112.663 -178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -72.28 -19.7 61.64 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.634 0.605 . . . . 74.230000000000004 112.634 176.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.5 tp -77.06 -34.73 57.06 Favored 'General case' 0 CA--C 1.557 1.221 0 O-C-N 122.181 -0.324 . . . . 74.329999999999998 111.471 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 83' ' ' THR . 44.1 mt -64.46 -33.58 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 121.862 0.839 . . . . 73.140000000000001 108.765 170.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -68.27 -29.93 68.84 Favored 'General case' 0 CA--C 1.551 1.015 0 CA-C-N 114.25 -1.341 . . . . 75.530000000000001 110.934 175.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 88.9 tttt -65.27 -50.01 67.38 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.655 0.382 . . . . 72.439999999999998 110.035 174.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.429 HG13 HG23 ' A' ' 68' ' ' ILE . 30.3 t -55.13 -45.29 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 C-N-CA 123.814 0.846 . . . . 72.340000000000003 110.698 174.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.416 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -56.72 -51.47 68.72 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 114.531 -1.213 . . . . 65.109999999999999 110.557 179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -63.3 -35.05 79.09 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.873 -1.058 . . . . 60.530000000000001 112.151 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.599 ' HB3' HD11 ' A' ' 68' ' ' ILE . 74.7 mmtt -60.97 -43.88 98.15 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.258 0.623 . . . . 73.340000000000003 112.425 176.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.453 ' HB3' HG23 ' A' ' 19' ' ' ILE . 4.3 mm? -70.87 -32.28 69.22 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 122.668 0.387 . . . . 64.239999999999995 111.84 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -62.62 -37.68 87.25 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.006 0.522 . . . . 65.25 110.74 168.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 18.1 ttt -70.06 -28.96 65.87 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.14 0.976 . . . . 54.030000000000001 112.215 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 93' ' ' LYS . 18.7 t -66.6 -38.89 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 CA-C-O 121.57 0.7 . . . . 72.310000000000002 109.857 173.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 48.7 m -65.57 -40.88 93.26 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.125 -0.943 . . . . 72.150000000000006 110.796 172.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -62.92 -35.38 79.9 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.69 0.796 . . . . 72.099999999999994 111.844 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -66.54 -44.01 83.59 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 124.145 0.978 . . . . 74.329999999999998 110.212 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.1 tp -72.32 -41.85 66.1 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 123.278 0.631 . . . . 65.329999999999998 111.188 176.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.1 -25.85 65.52 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.271 0.629 . . . . 71.310000000000002 111.46 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -57.95 -35.0 70.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.356 0.663 . . . . 70.010000000000005 111.011 173.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.6 mttp -77.44 -30.24 53.25 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.863 0.865 . . . . 74.329999999999998 111.87 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.7 -66.03 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.144 0 C-N-CA 123.55 0.74 . . . . 71.329999999999998 110.163 178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.4 m -76.54 81.37 3.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.096 0.958 . . . . 75.239999999999995 110.867 172.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -88.62 -145.68 11.54 Favored Glycine 0 CA--C 1.53 0.993 0 CA-C-N 115.789 -0.641 . . . . 62.130000000000003 112.671 176.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 56.5 m 52.02 66.56 1.17 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.183 0.993 . . . . 71.019999999999996 111.483 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 61.03 -82.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.73 1.212 . . . . 75.540000000000006 111.17 -173.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.69 164.86 36.71 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.33 1.052 . . . . 54.509999999999998 111.039 177.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.57 147.93 64.6 Favored Pre-proline 0 N--CA 1.486 1.36 0 C-N-CA 123.263 0.625 . . . . 52.219999999999999 111.681 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.97 105.64 0.15 Allowed 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.19 2.593 . . . . 73.109999999999999 113.113 175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.255 1.352 0 C-N-CA 123.769 0.828 . . . . 62.229999999999997 109.039 -174.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 120.509 0.195 . . . . 71.409999999999997 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.63 -100.04 0.56 Allowed Glycine 0 CA--C 1.539 1.552 0 N-CA-C 113.954 0.342 . . . . 65.010000000000005 113.954 -176.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.3 t -87.42 172.09 10.08 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.535 0.734 . . . . 45.310000000000002 112.575 -175.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -115.67 176.18 5.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 123.684 0.793 . . . . 72.530000000000001 112.088 178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -62.87 -30.74 71.75 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.624 1.169 . . . . 74.239999999999995 113.898 -175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -68.15 -29.99 69.0 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.417 0.525 . . . . 74.25 112.417 -178.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.421 ' O ' HG23 ' A' ' 11' ' ' VAL . 87.2 t80 -62.49 -49.08 76.8 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.387 0.675 . . . . 73.049999999999997 110.84 173.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.499 HG23 ' SD ' ' A' ' 56' ' ' MET . 50.4 mm -59.69 -41.54 85.6 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.234 0 C-N-CA 123.865 0.866 . . . . 74.420000000000002 110.797 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -60.0 -44.2 94.7 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.53 1.132 . . . . 62.450000000000003 111.921 175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -58.54 -51.3 70.49 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.961 0.904 . . . . 73.349999999999994 111.817 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 7' ' ' TYR . 60.0 t -59.93 -35.37 60.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 123.825 0.85 . . . . 75.019999999999996 111.794 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.502 HG23 HD21 ' A' ' 101' ' ' LEU . 91.8 m -60.76 -43.51 97.89 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.058 0.943 . . . . 53.140000000000001 111.788 175.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.424 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 61.3 m-20 -78.21 -28.4 47.97 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 113.413 0.894 . . . . 74.319999999999993 113.413 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.47 -28.74 70.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 122.681 0.392 . . . . 73.329999999999998 111.205 172.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HB3' ' O ' ' A' ' 12' ' ' THR . 4.2 tp -56.63 -36.15 69.15 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 124.265 1.026 . . . . 74.329999999999998 112.129 170.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 28.1 mmtp -70.69 -39.98 73.17 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.986 0.514 . . . . 72.439999999999998 111.456 -173.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -57.01 -41.94 79.43 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.205 1.002 . . . . 75.120000000000005 109.671 171.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 18' ' ' LEU . 8.8 tp -70.02 -39.64 75.69 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.165 -1.379 . . . . 75.109999999999999 111.501 -177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.64 -48.96 86.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 124.342 1.057 . . . . 73.129999999999995 110.714 174.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -61.51 -40.82 95.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.849 0.859 . . . . 73.209999999999994 111.552 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -68.15 -50.02 57.25 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 123.351 0.66 . . . . 75.319999999999993 111.275 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.8 t -58.25 -52.56 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.833 0.853 . . . . 73.530000000000001 112.013 177.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 92.5 m-20 -56.91 -39.55 74.65 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.197 0.599 . . . . 64.430000000000007 111.925 178.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.89 -36.56 84.74 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 123.103 0.561 . . . . 64.540000000000006 111.188 177.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 29' ' ' VAL . 59.8 m-20 -67.12 -43.39 82.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.274 0.63 . . . . 72.219999999999999 111.646 173.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.478 HG21 ' HG2' ' A' ' 91' ' ' LYS . 75.2 mt -62.07 -37.3 78.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.656 0.782 . . . . 73.030000000000001 111.274 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 28.1 mtpp -58.79 -42.3 88.72 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.417 0.687 . . . . 63.229999999999997 111.077 173.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -69.55 -26.98 64.76 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.571 -0.74 . . . . 71.409999999999997 112.361 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.559 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 41.3 t -72.41 -34.97 50.35 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 CA-C-O 120.742 0.306 . . . . 64.209999999999994 110.815 172.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.1 -24.38 67.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.854 -1.154 . . . . 73.349999999999994 110.979 173.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -83.68 -38.07 21.95 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.161 0.985 . . . . 72.129999999999995 110.773 174.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -136.07 82.49 36.15 Favored Pre-proline 0 N--CA 1.494 1.745 0 C-N-CA 125.16 1.384 . . . . 74.519999999999996 109.758 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -58.47 -44.07 40.61 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 123.515 2.81 . . . . 71.519999999999996 115.782 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.45 ' HA ' HD13 ' A' ' 82' ' ' ILE . 42.2 mt-10 -109.95 14.14 23.17 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.611 0.597 . . . . 74.310000000000002 112.611 -168.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.31 94.96 1.66 Allowed 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 121.792 0.806 . . . . 54.25 109.344 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.594 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 14.9 mmt -63.21 -27.1 69.13 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 114.054 -1.43 . . . . 75.040000000000006 113.932 -167.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -51.64 -44.96 63.16 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.839 0.856 . . . . 71.010000000000005 112.415 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -59.23 -41.2 88.12 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.959 0.504 . . . . 71.530000000000001 111.612 174.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.559 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 64.9 m95 -72.77 -28.86 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 113.326 0.861 . . . . 74.409999999999997 113.326 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.49 -43.7 96.49 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 118.804 0.729 . . . . 65.099999999999994 109.859 171.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 42.9 mtmt -61.67 -56.94 14.3 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.346 -0.843 . . . . 63.509999999999998 111.364 176.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.35 -38.22 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.925 0.89 . . . . 75.310000000000002 111.515 -178.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -59.04 -46.6 87.81 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.509 0.724 . . . . 63.509999999999998 111.385 176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 52.6 mtm-85 -70.49 -38.78 74.4 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.411 0.685 . . . . 71.140000000000001 112.243 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 73.6 mt -68.59 -39.96 80.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.384 0.674 . . . . 75.120000000000005 111.172 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.635 HG11 ' HB ' ' A' ' 68' ' ' ILE . 42.8 t -69.47 -36.87 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 123.896 0.879 . . . . 73.420000000000002 111.177 173.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -59.86 -34.25 72.88 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.066 0.546 . . . . 73.430000000000007 110.952 171.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.3 m -71.27 -40.47 70.91 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.913 -0.585 . . . . 74.310000000000002 110.512 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.9 mtt -62.01 -38.45 88.69 Favored 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.504 0.722 . . . . 62.149999999999999 111.657 174.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.16 -49.63 71.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.957 0.903 . . . . 70.129999999999995 110.287 175.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.87 -40.57 73.11 Favored 'General case' 0 CA--C 1.557 1.228 0 C-N-CA 124.259 1.024 . . . . 74.540000000000006 111.767 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.401 HG23 HG12 ' A' ' 11' ' ' VAL . 69.3 mt -59.61 -60.15 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 123.981 0.912 . . . . 74.099999999999994 110.363 175.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.514 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 10.2 t -65.77 -27.99 68.7 Favored 'General case' 0 CA--C 1.559 1.306 0 N-CA-C 112.44 0.533 . . . . 73.219999999999999 112.44 -174.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.95 -46.21 78.97 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.025 0.53 . . . . 73.0 111.666 172.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.6 t -72.91 -20.46 61.07 Favored 'General case' 0 N--CA 1.498 1.973 0 CA-C-O 120.723 0.296 . . . . 75.439999999999998 111.383 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.499 ' SD ' HG23 ' A' ' 8' ' ' ILE . 70.5 mmm -79.04 -15.25 58.48 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.449 171.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.98 -4.37 67.93 Favored Glycine 0 CA--C 1.541 1.659 0 N-CA-C 114.288 0.475 . . . . 63.420000000000002 114.288 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.514 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 57.3 m-85 -86.88 86.84 7.35 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 123.965 0.906 . . . . 73.530000000000001 112.089 -175.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 54.9 m -68.41 -29.54 68.24 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 123.042 0.537 . . . . 63.119999999999997 111.82 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.5 t -59.4 -46.74 87.84 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.701 0.8 . . . . 71.430000000000007 111.822 177.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.434 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 29.2 t -69.76 -39.52 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.703 -0.681 . . . . 71.219999999999999 110.401 178.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.58 -33.72 66.45 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 112.589 0.589 . . . . 72.319999999999993 112.589 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' O ' HG23 ' A' ' 67' ' ' THR . 25.4 mtpp -67.52 -37.84 83.37 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.784 0.677 . . . . 71.519999999999996 112.062 175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.3 t -62.84 -42.96 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.179 0.592 . . . . 73.25 110.765 175.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.633 HD12 HG13 ' A' ' 46' ' ' VAL . 3.7 mm? -73.95 -27.79 61.18 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.519 0.728 . . . . 73.519999999999996 110.723 176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.401 ' HA ' ' HG3' ' A' ' 69' ' ' MET . 53.3 t-80 -69.19 -30.02 68.13 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.013 0.925 . . . . 70.530000000000001 111.313 177.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 63' ' ' LYS . 30.3 p -69.88 -26.04 63.99 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 120.495 0.188 . . . . 73.420000000000002 110.748 176.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.635 ' HB ' HG11 ' A' ' 46' ' ' VAL . 5.5 mm -76.98 -32.9 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 N-CA-C 108.996 -0.742 . . . . 75.200000000000003 108.996 -177.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.401 ' HG3' ' HA ' ' A' ' 66' ' ' HIS . 25.6 mtp -61.1 -46.91 88.7 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.265 -0.879 . . . . 52.329999999999998 110.39 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -62.99 -47.62 82.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.936 0.494 . . . . 65.409999999999997 111.116 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -57.0 -57.1 14.04 Favored 'General case' 0 CA--C 1.56 1.351 0 C-N-CA 124.609 1.164 . . . . 71.109999999999999 111.027 -175.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.87 -39.72 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.334 1.054 . . . . 73.099999999999994 112.396 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -59.68 -34.39 72.79 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 122.678 0.391 . . . . 63.130000000000003 111.741 178.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HB3' HG13 ' A' ' 80' ' ' ILE . 52.0 mtmt -71.54 -30.32 65.76 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.273 0.629 . . . . 73.120000000000005 112.003 175.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 42.2 mtt -60.53 -37.84 82.52 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 122.438 0.295 . . . . 72.140000000000001 111.343 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.594 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.5 mm? -56.07 -19.71 14.07 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 124.642 1.177 . . . . 75.319999999999993 113.74 179.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -112.78 144.41 42.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.44 0.696 . . . . 53.109999999999999 111.732 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 66.6 m -64.61 -13.53 53.88 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.74 1.216 . . . . 62.530000000000001 113.283 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.694 ' HG3' HG12 ' A' ' 80' ' ' ILE . 13.0 pt-20 -77.48 -16.93 58.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.132 0.573 . . . . 74.239999999999995 112.06 -176.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.694 HG12 ' HG3' ' A' ' 79' ' ' GLU . 8.5 mm -125.15 -65.86 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 123.595 0.758 . . . . 74.540000000000006 109.852 -178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt 59.7 -161.08 0.28 Allowed 'General case' 0 CA--C 1.561 1.366 0 C-N-CA 124.697 1.199 . . . . 73.540000000000006 112.466 -177.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.587 HG22 ' H ' ' A' ' 84' ' ' SER . 3.1 mp -103.98 123.24 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 123.539 0.736 . . . . 73.530000000000001 109.92 -174.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 3.8 m -86.13 25.62 1.14 Allowed 'General case' 0 CA--C 1.569 1.707 0 C-N-CA 123.401 0.68 . . . . 65.200000000000003 111.564 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.587 ' H ' HG22 ' A' ' 82' ' ' ILE . 63.4 m 61.21 -71.86 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.357 1.463 . . . . 70.519999999999996 112.299 -176.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.29 -18.71 63.89 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.273 1.029 . . . . 74.439999999999998 112.606 175.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.403 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 30.6 tp -58.0 -31.84 67.33 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.461 0.704 . . . . 73.129999999999995 112.355 174.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 59.7 mt -61.15 -32.44 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 C-N-CA 123.209 0.604 . . . . 72.030000000000001 111.101 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.49 -30.58 70.94 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.281 0.632 . . . . 63.409999999999997 111.265 176.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -64.97 -39.26 93.21 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.138 0.575 . . . . 64.549999999999997 110.295 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 15.0 t -67.87 -41.41 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.334 0.654 . . . . 74.019999999999996 110.715 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.478 ' HG2' HG21 ' A' ' 26' ' ' ILE . 34.8 mtmm -62.99 -39.44 94.74 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.096 0.558 . . . . 72.230000000000004 112.224 178.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -68.99 -36.74 78.18 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 122.933 0.493 . . . . 74.530000000000001 111.962 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 97' ' ' VAL . 34.5 mmtp -68.31 -41.72 80.45 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 116.088 -0.505 . . . . 73.400000000000006 111.913 177.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.77 -29.83 63.62 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 123.248 0.619 . . . . 73.200000000000003 109.549 177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.77 -46.42 90.54 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.633 0.773 . . . . 71.140000000000001 109.279 170.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -39.12 84.71 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.885 1.274 . . . . 64.239999999999995 111.658 178.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 93' ' ' LYS . 62.5 t -58.37 -44.16 87.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 C-N-CA 123.32 0.648 . . . . 64.340000000000003 110.865 174.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 84.9 m -65.28 -40.99 94.59 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.66 0.784 . . . . 61.32 111.328 175.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -69.8 -34.52 73.82 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 123.871 0.868 . . . . 71.200000000000003 111.821 -178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -69.37 -41.63 76.27 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.481 0.712 . . . . 73.409999999999997 110.549 178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.502 HD21 HG23 ' A' ' 12' ' ' THR . 0.4 OUTLIER -70.23 -37.17 74.93 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 122.979 0.512 . . . . 64.519999999999996 110.075 176.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -59.69 -36.13 75.86 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.75 0.82 . . . . 73.219999999999999 110.803 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 24.6 tptp -84.74 -22.92 29.5 Favored 'General case' 0 CA--C 1.564 1.495 0 C-N-CA 123.972 0.909 . . . . 74.420000000000002 111.52 176.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.6 tppt? -71.25 -37.86 71.93 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.807 0.843 . . . . 71.519999999999996 111.712 -175.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.1 m -65.16 -23.43 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 123.164 0.586 . . . . 75.010000000000005 111.687 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.0 t -87.7 90.68 8.47 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.267 0.627 . . . . 43.140000000000001 109.448 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 122.31 144.91 6.88 Favored Glycine 0 N--CA 1.479 1.538 0 CA-C-N 115.718 -0.674 . . . . 60.340000000000003 112.381 -175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 44.6 t -89.46 91.87 8.89 Favored 'General case' 0 N--CA 1.488 1.45 0 CA-C-O 121.355 0.598 . . . . 61.310000000000002 111.008 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -96.37 33.5 1.77 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.133 0.973 . . . . 72.329999999999998 111.701 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.7 mp -86.87 54.05 3.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.798 0.839 . . . . 54.340000000000003 110.509 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.7 m -113.97 134.25 22.18 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 123.729 0.812 . . . . 75.450000000000003 110.991 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.61 -9.4 14.71 Favored 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.396 2.064 . . . . 75.230000000000004 112.38 171.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 . . . . . 0 CA--C 1.56 1.336 0 C-N-CA 124.127 0.971 . . . . 73.450000000000003 109.711 -179.333 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.8 ptp . . . . . 0 N--CA 1.484 1.241 0 CA-C-O 120.863 0.363 . . . . 63.109999999999999 111.047 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.26 -123.71 1.22 Allowed Glycine 0 CA--C 1.529 0.933 0 CA-C-O 119.664 -0.52 . . . . 34.509999999999998 111.984 -176.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 42.8 m 61.27 -88.04 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.614 1.166 . . . . 74.219999999999999 110.791 -172.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 49.97 110.49 0.0 OUTLIER 'General case' 0 C--N 1.369 1.414 0 C-N-CA 125.362 1.465 . . . . 73.120000000000005 114.154 177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -54.26 -29.0 45.29 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.375 0.67 . . . . 73.219999999999999 111.967 175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -58.77 -54.34 48.15 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.999 0.92 . . . . 43.420000000000002 110.543 174.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -60.09 -40.09 88.38 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.405 1.082 . . . . 74.209999999999994 111.547 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 51.6 mm -64.21 -45.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 123.384 0.674 . . . . 62.039999999999999 111.308 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -63.28 -31.11 72.17 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.502 0.721 . . . . 74.510000000000005 111.726 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -65.6 -50.56 64.64 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.867 0.467 . . . . 64.409999999999997 111.045 174.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 71.9 t -60.56 -38.94 79.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 C-N-CA 123.118 0.567 . . . . 73.400000000000006 111.164 178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.46 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 86.0 m -63.14 -38.74 92.37 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.237 -0.892 . . . . 70.510000000000005 111.079 174.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.533 ' HA ' ' HD3' ' A' ' 16' ' ' LYS . 5.6 t70 -77.31 -30.48 54.13 Favored 'General case' 0 CA--C 1.562 1.437 0 C-N-CA 123.033 0.533 . . . . 71.519999999999996 111.844 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.91 -26.58 66.93 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.192 0.997 . . . . 72.219999999999999 110.745 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tt -63.32 -32.55 74.0 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.613 0.765 . . . . 71.420000000000002 111.176 171.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 0.6 OUTLIER -68.57 -41.52 79.61 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 122.831 0.452 . . . . 71.109999999999999 110.711 173.699 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -57.1 -39.69 75.55 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-O 121.683 0.754 . . . . 54.340000000000003 110.886 172.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.2 tp -70.66 -43.28 69.47 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 114.505 -1.225 . . . . 74.209999999999994 110.737 -177.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.3 mt -59.45 -44.69 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.973 0.909 . . . . 73.25 110.933 173.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -63.91 -45.2 90.35 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.707 0.803 . . . . 74.340000000000003 111.949 -179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.02 -51.46 32.05 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.52 0.328 . . . . 73.439999999999998 110.466 -177.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 26' ' ' ILE . 43.0 t -55.22 -54.99 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 123.644 0.778 . . . . 70.209999999999994 111.91 177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -58.45 -35.48 72.2 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.97 0.508 . . . . 74.129999999999995 112.362 -179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 16.9 t70 -74.45 -33.2 62.85 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.195 0.198 . . . . 71.329999999999998 111.147 177.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.498 ' O ' HG23 ' A' ' 29' ' ' VAL . 40.8 m-20 -62.74 -40.38 97.04 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 122.945 0.498 . . . . 62.439999999999998 110.508 169.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 53.6 mt -67.91 -34.75 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.433 0.693 . . . . 74.430000000000007 110.379 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 9.4 mtpm? -65.19 -35.94 82.63 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.464 0.706 . . . . 71.129999999999995 111.392 175.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -68.41 -29.24 67.88 Favored 'General case' 0 CA--C 1.556 1.186 0 CA-C-N 115.434 -0.803 . . . . 75.140000000000001 111.62 171.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.522 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 61.8 t -73.86 -38.22 49.87 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.438 0 C-N-CA 122.684 0.394 . . . . 60.450000000000003 111.483 172.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 56.4 mt-10 -58.22 -29.29 65.59 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.875 -0.516 . . . . 73.140000000000001 111.628 -177.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.76 -36.79 14.95 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 122.951 0.501 . . . . 70.150000000000006 111.509 174.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -129.22 85.56 59.2 Favored Pre-proline 0 N--CA 1.497 1.887 0 C-N-CA 124.058 0.943 . . . . 70.450000000000003 109.772 -177.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -67.31 -38.54 15.02 Favored 'Trans proline' 0 C--N 1.381 2.258 0 C-N-CA 123.118 2.545 . . . . 72.25 114.748 -163.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -84.91 8.79 16.3 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.057 0.762 . . . . 73.319999999999993 113.057 -171.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -74.46 101.43 4.13 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-O 121.454 0.645 . . . . 63.43 109.648 177.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.458 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 27.5 mmt -76.33 -23.13 54.25 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.123 0.969 . . . . 75.019999999999996 112.928 -173.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.87 -37.8 73.07 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.809 0.444 . . . . 70.239999999999995 111.616 174.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -62.79 -42.24 99.62 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.53 0.332 . . . . 74.540000000000006 110.411 170.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.522 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 58.4 m95 -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.656 0.613 . . . . 73.239999999999995 112.656 175.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -69.93 -38.78 76.31 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 122.895 0.478 . . . . 71.230000000000004 110.715 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -53.48 -55.99 20.74 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.615 0.766 . . . . 54.240000000000002 110.76 170.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 22' ' ' VAL . 58.6 mt -56.4 -44.49 80.25 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 114.666 -1.152 . . . . 64.310000000000002 111.111 178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -62.37 -44.75 95.73 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 124.265 1.026 . . . . 62.350000000000001 112.24 -178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 47' ' ' HIS . 81.8 mtp180 -70.46 -40.83 73.47 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.708 0.803 . . . . 72.010000000000005 112.271 -178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.8 mt -76.34 -36.69 58.11 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 123.02 0.528 . . . . 73.099999999999994 111.55 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.575 HG13 HD12 ' A' ' 65' ' ' LEU . 39.8 t -67.6 -32.77 58.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 123.709 0.803 . . . . 71.129999999999995 111.104 172.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 44' ' ' ARG . 46.6 t-80 -56.33 -39.69 73.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.403 0.681 . . . . 75.109999999999999 110.595 170.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 93.8 m -71.11 -41.65 70.3 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 116.037 -0.529 . . . . 71.310000000000002 111.115 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -57.05 -41.56 78.91 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 122.82 0.448 . . . . 61.020000000000003 111.754 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.485 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 26.6 ttpp -61.42 -53.75 52.5 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 124.065 0.853 . . . . 75.299999999999997 111.1 -179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.88 -30.31 71.3 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 112.561 0.578 . . . . 75.519999999999996 112.561 -178.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 84.2 mt -60.05 -55.29 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 C-N-CA 122.695 0.398 . . . . 62.049999999999997 111.022 172.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.538 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.6 t -68.57 -28.88 67.34 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 112.819 0.674 . . . . 60.210000000000001 112.819 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 45.8 mt-10 -61.87 -44.72 96.24 Favored 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 121.351 0.595 . . . . 75.099999999999994 110.989 172.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 34.9 m -65.85 -33.59 76.2 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 114.716 -1.129 . . . . 72.030000000000001 110.971 177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 60.5 mtt -75.37 -9.36 58.49 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.492 0.717 . . . . 74.409999999999997 112.43 174.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.6 -0.73 74.46 Favored Glycine 0 N--CA 1.48 1.583 0 N-CA-C 114.204 0.442 . . . . 61.43 114.204 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.538 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 86.7 m-85 -86.74 83.9 7.48 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.68 0.792 . . . . 75.329999999999998 110.714 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.1 m -68.54 -26.78 65.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.261 0.624 . . . . 74.329999999999998 111.344 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 56.4 p -68.17 -40.29 82.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.551 1.14 . . . . 65.319999999999993 111.815 177.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 45.2 t -73.06 -44.79 55.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.738 0.415 . . . . 74.239999999999995 110.187 174.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.05 -32.97 64.55 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.466 0.706 . . . . 70.040000000000006 111.839 175.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 67' ' ' THR . 61.2 tttp -57.75 -51.13 70.81 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.2 1.0 . . . . 75.319999999999993 111.13 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.8 -43.12 94.7 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 123.407 0.683 . . . . 72.5 111.476 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.575 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -70.79 -31.16 67.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.788 0.435 . . . . 63.549999999999997 111.493 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -70.66 -29.29 65.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.558 0.743 . . . . 74.140000000000001 110.875 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 63' ' ' LYS . 26.0 p -70.1 -26.44 63.98 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 110.468 -0.197 . . . . 63.100000000000001 110.468 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 16.8 mm -76.41 -33.82 23.86 Favored 'Isoleucine or valine' 0 C--N 1.354 0.801 0 N-CA-C 108.877 -0.786 . . . . 73.019999999999996 108.877 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 18.8 mtp -63.33 -46.96 84.21 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.221 -0.899 . . . . 72.010000000000005 110.402 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -57.65 -46.73 83.82 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.8 0.84 . . . . 74.120000000000005 111.643 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.46 -57.79 9.95 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 125.146 1.378 . . . . 73.239999999999995 111.468 -174.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 99.8 t -64.11 -41.77 93.49 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.08 0 C-N-CA 124.13 0.972 . . . . 55.130000000000003 112.091 -177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -57.11 -30.93 64.8 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.668 0.787 . . . . 72.510000000000005 111.67 177.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -69.72 -40.17 76.39 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.306 0.643 . . . . 74.230000000000004 112.165 174.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.406 ' HE2' HG23 ' A' ' 82' ' ' ILE . 55.9 mtt -59.44 -34.89 73.06 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.755 0.422 . . . . 64.409999999999997 111.991 178.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.458 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 4.4 mm? -55.71 -42.63 75.56 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.149 0.98 . . . . 73.140000000000001 112.577 175.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.547 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -82.57 138.46 34.24 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 121.373 0.606 . . . . 75.430000000000007 111.701 178.239 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 59.5 m -66.04 -10.13 37.1 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 125.053 1.341 . . . . 73.530000000000001 113.312 -173.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' ASN . 11.9 pt-20 -77.11 -12.93 60.0 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.123 0.569 . . . . 73.340000000000003 111.233 179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.5 mm -123.55 131.48 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 124.792 1.237 . . . . 74.150000000000006 109.899 -178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -98.87 159.23 15.1 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.15 0.58 . . . . 71.510000000000005 110.976 176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.411 ' N ' HD12 ' A' ' 82' ' ' ILE . 3.5 mp -98.68 92.62 2.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.284 0.634 . . . . 75.209999999999994 109.821 -175.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 26.8 m -76.64 140.09 40.84 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.365 -0.834 . . . . 70.0 110.401 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.452 ' HA ' HD12 ' A' ' 87' ' ' ILE . 67.0 m -56.72 -39.59 74.19 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.726 0.81 . . . . 73.519999999999996 112.819 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -76.62 -21.71 55.15 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 112.496 0.554 . . . . 74.25 112.496 176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.6 tp -75.03 -34.18 61.85 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.707 -0.621 . . . . 71.230000000000004 110.754 172.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.452 HD12 ' HA ' ' A' ' 84' ' ' SER . 63.2 mt -60.99 -34.38 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 C-N-CA 123.369 0.667 . . . . 74.510000000000005 109.514 169.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.03 -29.8 69.71 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.041 -0.981 . . . . 62.350000000000001 111.166 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -64.97 -39.32 93.31 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.13 0.572 . . . . 74.049999999999997 110.452 176.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 18.4 t -70.29 -45.17 76.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 115.398 -0.819 . . . . 72.420000000000002 110.695 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.402 ' HG2' HG21 ' A' ' 26' ' ' ILE . 23.5 mmtp -55.24 -49.32 72.33 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.706 0.802 . . . . 74.109999999999999 111.538 173.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 14.0 tppt? -62.26 -41.15 98.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.478 1.111 . . . . 74.329999999999998 112.458 -175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -75.4 -28.31 59.38 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.617 -0.719 . . . . 74.420000000000002 112.468 179.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.41 -30.63 60.15 Favored 'General case' 0 CA--C 1.564 1.497 0 N-CA-C 109.282 -0.636 . . . . 63.539999999999999 109.282 174.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -64.7 -41.36 96.08 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.193 0.997 . . . . 72.230000000000004 110.443 168.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 14.2 tpt -63.89 -31.16 72.25 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.27 1.028 . . . . 65.349999999999994 112.059 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 59.6 t -58.19 -48.74 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.868 0 CA-C-O 121.411 0.624 . . . . 75.510000000000005 110.301 171.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.7 m -63.34 -39.01 93.38 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.823 -1.08 . . . . 61.409999999999997 111.564 176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -70.26 -34.04 72.34 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.662 0.785 . . . . 73.510000000000005 112.892 -178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -34.67 61.19 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.568 -0.53 . . . . 71.310000000000002 109.568 179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 26.4 tp -72.35 -29.45 63.81 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-O 121.021 0.439 . . . . 74.310000000000002 110.765 171.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -68.06 -32.59 73.04 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.632 0.773 . . . . 41.030000000000001 110.631 175.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 37.1 mmtm -64.6 -27.88 69.25 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.786 0.834 . . . . 64.140000000000001 112.078 172.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -69.86 -47.84 61.11 Favored 'General case' 0 N--CA 1.49 1.559 0 CA-C-O 121.205 0.526 . . . . 75.319999999999993 110.352 175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 58.2 t -65.69 -38.59 82.67 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.888 0.875 . . . . 74.25 111.18 178.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.1 t -74.38 -26.14 59.92 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.904 0.882 . . . . 53.439999999999998 112.003 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 77.55 68.36 1.52 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.572 -0.285 . . . . 42.329999999999998 112.463 -178.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 38.8 t -151.54 122.4 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.304 0.641 . . . . 64.109999999999999 110.392 179.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.58 137.68 40.95 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.705 0.802 . . . . 74.109999999999999 111.528 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.577 HD23 ' H ' ' A' ' 110' ' ' LEU . 2.4 pt? -79.59 132.7 36.34 Favored 'General case' 0 CA--C 1.557 1.224 0 C-N-CA 123.391 0.676 . . . . 74.329999999999998 111.25 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 14.9 m -130.72 159.3 71.73 Favored Pre-proline 0 N--CA 1.492 1.667 0 C-N-CA 124.748 1.219 . . . . 74.340000000000003 110.8 -176.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.7 82.33 0.32 Allowed 'Trans proline' 0 C--N 1.39 2.713 0 C-N-CA 122.734 2.29 . . . . 74.099999999999994 114.081 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 . . . . . 0 CA--C 1.56 1.357 0 C-N-CA 124.271 1.029 . . . . 70.150000000000006 109.854 173.849 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 mtt . . . . . 0 N--CA 1.484 1.242 0 N-CA-C 109.895 -0.409 . . . . 64.040000000000006 109.895 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -112.66 -123.08 4.09 Favored Glycine 0 N--CA 1.476 1.355 0 CA-C-O 119.86 -0.411 . . . . 74.329999999999998 112.369 178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 68.0 p -68.62 99.1 0.95 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.437 0.695 . . . . 75.200000000000003 112.567 -175.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -70.95 103.74 2.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.111 0.564 . . . . 72.340000000000003 110.943 176.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.507 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 49.3 mt-30 -64.51 -38.66 91.79 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.494 0.718 . . . . 74.200000000000003 110.887 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -50.57 -47.32 57.91 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 124.967 1.307 . . . . 63.32 111.818 173.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' O ' HG23 ' A' ' 11' ' ' VAL . 67.1 t80 -59.84 -50.08 75.2 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.003 -0.998 . . . . 63.310000000000002 111.003 177.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 49.3 mm -57.5 -45.06 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 123.931 0.892 . . . . 64.540000000000006 112.463 -178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HD3' ' O ' ' A' ' 5' ' ' GLN . 4.3 mptp? -60.44 -40.9 92.8 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.509 0.724 . . . . 64.299999999999997 111.394 178.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.0 mttp -65.15 -44.49 88.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.588 0.355 . . . . 51.420000000000002 111.886 174.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 7' ' ' TYR . 59.3 t -60.96 -29.29 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.414 1.086 . . . . 70.25 112.87 -176.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.455 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 71.3 p -63.59 -47.94 79.44 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.31 0.244 . . . . 53.509999999999998 111.284 177.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -76.89 -28.18 55.27 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.378 0.881 . . . . 70.120000000000005 113.378 175.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 46.9 mt-10 -60.93 -29.84 69.86 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 118.128 0.422 . . . . 55.210000000000001 110.788 168.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.481 HD21 HG12 ' A' ' 97' ' ' VAL . 8.7 tt -66.75 -43.96 82.75 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.784 0.834 . . . . 71.239999999999995 110.79 172.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.41 ' HE3' HD23 ' A' ' 101' ' ' LEU . 1.2 mptm? -61.29 -41.46 96.99 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 123.059 0.544 . . . . 72.140000000000001 111.196 174.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -63.15 -38.77 92.49 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.882 0.873 . . . . 74.219999999999999 111.141 176.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.473 HD11 HD22 ' A' ' 45' ' ' LEU . 5.8 tp -68.27 -42.85 78.97 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.828 -1.078 . . . . 73.129999999999995 110.829 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.509 HG23 HD13 ' A' ' 94' ' ' LEU . 85.9 mt -59.78 -46.2 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 124.514 1.125 . . . . 72.329999999999998 110.955 172.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -54.34 -44.98 72.57 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.003 0.921 . . . . 74.340000000000003 111.652 174.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.27 -45.5 69.54 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 115.707 -0.679 . . . . 75.230000000000004 112.075 -179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -66.1 -41.64 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.161 0.584 . . . . 55.240000000000002 111.618 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 85.4 m-20 -50.82 -49.05 59.55 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.231 0.613 . . . . 74.040000000000006 110.452 170.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -63.29 -44.38 95.21 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.236 1.014 . . . . 53.130000000000003 111.772 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -65.07 -37.55 87.89 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.255 0.622 . . . . 63.399999999999999 111.692 177.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.587 HG21 ' HG2' ' A' ' 91' ' ' LYS . 96.4 mt -69.21 -35.34 67.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.295 0.638 . . . . 64.049999999999997 111.415 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 26.1 mtpp -61.46 -29.11 69.75 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 112.715 0.635 . . . . 74.400000000000006 112.715 -178.29 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -67.69 -36.99 81.68 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.25 0.62 . . . . 74.120000000000005 111.281 170.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.462 HG11 ' CE2' ' A' ' 39' ' ' TRP . 12.1 t -76.27 -25.78 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 123.628 0.771 . . . . 61.520000000000003 112.096 178.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -63.31 -23.88 67.61 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.987 -0.446 . . . . 73.099999999999994 111.82 178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -91.46 -46.94 7.71 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.012 0.525 . . . . 63.200000000000003 110.761 168.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -113.24 85.34 8.31 Favored Pre-proline 0 CA--C 1.56 1.349 0 CA-C-N 115.459 -0.791 . . . . 63.399999999999999 110.911 -173.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -62.18 -34.52 78.69 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.875 2.384 . . . . 75.109999999999999 113.996 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -85.65 12.45 8.77 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.775 0.83 . . . . 70.549999999999997 112.904 -174.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -79.31 83.01 5.39 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 121.242 0.544 . . . . 72.019999999999996 110.158 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.647 ' SD ' HD22 ' A' ' 76' ' ' LEU . 13.6 mmt -72.98 -20.27 61.06 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.274 0.842 . . . . 72.519999999999996 113.274 -177.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -58.39 -45.79 87.64 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.006 0.523 . . . . 65.510000000000005 110.633 169.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -70.77 -31.55 68.39 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.151 0.58 . . . . 62.039999999999999 112.139 175.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.462 ' CE2' HG11 ' A' ' 29' ' ' VAL . 80.9 m95 -68.13 -28.07 67.0 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.38 0.511 . . . . 74.430000000000007 112.38 172.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -64.83 -43.98 91.29 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 122.865 0.466 . . . . 73.010000000000005 110.608 172.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -54.21 -54.99 32.41 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.387 -0.824 . . . . 55.310000000000002 111.252 173.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.21 -44.52 92.1 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 C-N-CA 124.587 1.155 . . . . 53.219999999999999 111.764 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 43.0 t80 -63.43 -42.39 98.71 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.659 0.784 . . . . 72.109999999999999 112.364 -175.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -64.05 -44.6 91.97 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.247 0.619 . . . . 61.329999999999998 111.562 178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD22 HD11 ' A' ' 18' ' ' LEU . 72.9 mt -70.22 -36.75 74.77 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.033 -0.53 . . . . 73.310000000000002 111.509 -177.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.524 HG11 ' HB ' ' A' ' 68' ' ' ILE . 72.4 t -71.35 -33.66 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 C-N-CA 122.985 0.514 . . . . 63.409999999999997 111.473 175.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -59.09 -38.14 78.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.528 0.331 . . . . 60.409999999999997 110.452 172.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.463 ' O ' HG13 ' A' ' 52' ' ' ILE . 30.0 m -67.11 -46.93 72.71 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 115.778 -0.647 . . . . 70.409999999999997 110.804 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.7 mtt -57.13 -42.23 80.54 Favored 'General case' 0 N--CA 1.5 2.052 0 C-N-CA 123.631 0.772 . . . . 74.140000000000001 112.871 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -64.07 -44.5 92.22 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 116.053 -0.522 . . . . 64.040000000000006 110.376 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.19 -37.12 76.64 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 123.641 0.776 . . . . 42.200000000000003 112.07 176.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 48' ' ' THR . 89.9 mt -59.34 -56.01 19.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 123.92 0.888 . . . . 54.310000000000002 110.987 177.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.7 t -68.89 -29.75 68.09 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 112.655 0.613 . . . . 74.340000000000003 112.655 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.36 -42.67 83.07 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 122.509 0.324 . . . . 62.420000000000002 111.461 175.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.1 t -75.53 -21.57 57.83 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 122.459 0.303 . . . . 73.430000000000007 111.358 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtt -78.48 -11.64 59.97 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.152 0.581 . . . . 75.129999999999995 111.621 168.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.32 -3.35 79.5 Favored Glycine 0 C--N 1.351 1.397 0 N-CA-C 114.096 0.398 . . . . 52.100000000000001 114.096 175.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.418 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.1 m-85 -79.84 89.67 5.26 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.372 0.669 . . . . 72.040000000000006 111.096 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.429 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 70.9 m -75.11 -30.12 60.79 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.519 0.328 . . . . 73.230000000000004 111.442 175.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 43.0 m -61.43 -44.81 96.48 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.62 0.768 . . . . 65.340000000000003 111.121 175.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.3 t -72.03 -37.48 60.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 115.7 -0.682 . . . . 64.209999999999994 110.844 176.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.67 -32.54 67.42 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.086 0.554 . . . . 51.009999999999998 111.937 177.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 59' ' ' SER . 96.4 mttt -57.99 -39.45 78.28 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.44 0.696 . . . . 74.310000000000002 112.144 174.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.0 t -64.17 -49.36 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.141 0.576 . . . . 70.140000000000001 110.706 178.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.4 -28.07 64.79 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.962 0.905 . . . . 74.400000000000006 111.365 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -65.88 -28.58 69.06 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.338 1.055 . . . . 73.0 110.857 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 32.7 p -64.43 -47.06 80.51 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 122.952 0.158 . . . . 71.420000000000002 111.253 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.53 ' H ' HD12 ' A' ' 68' ' ' ILE . 4.7 mp -63.74 -33.44 61.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.394 0 C-N-CA 123.212 0.605 . . . . 64.340000000000003 111.213 -178.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 68.5 mmm -59.08 -55.45 34.96 Favored 'General case' 0 N--CA 1.492 1.636 0 CA-C-O 121.75 0.786 . . . . 63.109999999999999 111.318 176.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -64.5 -32.17 73.69 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 114.262 -1.335 . . . . 63.43 111.627 179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.9 tt -69.02 -58.85 3.54 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 114.696 -1.138 . . . . 61.310000000000002 110.613 -177.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.5 t -65.16 -41.55 92.02 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 124.12 0.968 . . . . 75.409999999999997 111.597 -176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -60.86 -37.06 80.82 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.545 0.738 . . . . 64.510000000000005 112.14 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -77.79 -42.2 34.77 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 112.52 0.563 . . . . 74.409999999999997 112.52 177.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.543 ' SD ' HD23 ' A' ' 86' ' ' LEU . 38.0 mtm -61.11 -31.91 71.6 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-N 118.026 0.376 . . . . 55.119999999999997 111.144 176.235 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.647 HD22 ' SD ' ' A' ' 36' ' ' MET . 0.2 OUTLIER -50.15 -42.05 50.12 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 125.199 1.4 . . . . 61.409999999999997 111.092 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.04 139.45 31.75 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.62 0.724 . . . . 62.119999999999997 111.016 171.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 73.5 m -72.12 -2.99 20.59 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.74 1.216 . . . . 74.400000000000006 113.559 -176.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.451 ' HG3' HG12 ' A' ' 80' ' ' ILE . 9.8 pt-20 -77.28 -31.9 55.17 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 121.407 0.622 . . . . 74.310000000000002 110.014 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.451 HG12 ' HG3' ' A' ' 79' ' ' GLU . 11.5 mm -95.43 -58.11 3.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.329 1.052 . . . . 73.140000000000001 109.185 176.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.517 ' HG2' ' H ' ' A' ' 82' ' ' ILE . 81.4 tttt 66.61 174.86 0.24 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 124.42 1.088 . . . . 74.439999999999998 111.072 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.54 ' H ' HD12 ' A' ' 82' ' ' ILE . 3.8 mp -83.41 130.99 34.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 C-N-CA 124.319 1.048 . . . . 74.450000000000003 109.037 -175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.624 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 6.6 m -89.05 25.69 1.77 Allowed 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.084 0.469 . . . . 54.439999999999998 111.252 -178.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.441 ' H ' HG22 ' A' ' 82' ' ' ILE . 66.1 m 56.06 -75.34 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 126.016 1.726 . . . . 74.129999999999995 113.265 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -60.62 -22.24 63.56 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.501 1.12 . . . . 51.530000000000001 112.141 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.624 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 21.7 tp -63.66 -31.26 72.38 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.622 0.769 . . . . 75.530000000000001 112.827 179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 65.3 mt -52.94 -33.37 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 122.986 0.514 . . . . 70.030000000000001 111.061 171.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -68.87 -29.93 68.33 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.293 0.637 . . . . 74.420000000000002 111.554 177.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -70.61 -39.89 73.5 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 122.773 0.429 . . . . 64.049999999999997 110.907 174.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.424 HG11 ' HZ3' ' A' ' 39' ' ' TRP . 21.4 t -61.86 -43.48 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 122.947 0.499 . . . . 71.120000000000005 110.052 173.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.587 ' HG2' HG21 ' A' ' 26' ' ' ILE . 0.0 OUTLIER -57.74 -51.79 68.11 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-N 115.556 -0.747 . . . . 72.219999999999999 111.234 172.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.428 ' NZ ' ' HB2' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -66.92 -47.47 71.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.891 0.876 . . . . 52.219999999999999 112.514 -169.089 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.464 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.3 mmtt -57.76 -50.32 73.62 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.726 0.811 . . . . 50.210000000000001 111.389 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.509 HD13 HG23 ' A' ' 19' ' ' ILE . 2.7 tm? -64.91 -34.32 78.13 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.427 1.091 . . . . 75.25 111.393 -179.165 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -65.62 -44.11 87.52 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.325 1.05 . . . . 61.32 110.706 173.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 39.3 tpp -67.48 -26.67 66.49 Favored 'General case' 0 C--O 1.208 -1.128 0 CA-C-N 114.628 -1.169 . . . . 71.129999999999995 112.081 -178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.481 HG12 HD21 ' A' ' 15' ' ' LEU . 54.7 t -58.63 -39.03 74.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 CA-C-N 118.826 0.739 . . . . 74.430000000000007 111.947 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.9 m -62.57 -45.72 91.61 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.712 0.768 . . . . 75.120000000000005 110.737 172.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.428 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 10.3 tpt180 -71.56 -35.86 70.73 Favored 'General case' 0 CA--C 1.563 1.444 0 CA-C-N 114.443 -1.253 . . . . 54.229999999999997 112.39 -173.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HB3' ' A' ' 103' ' ' LYS . 0.8 OUTLIER -80.37 -30.32 37.89 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.719 0.808 . . . . 72.5 111.153 -179.84 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.41 HD23 ' HE3' ' A' ' 16' ' ' LYS . 23.7 tp -71.6 -28.88 64.11 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.436 0.636 . . . . 65.340000000000003 110.244 173.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 30.0 t70 -59.88 -29.47 68.34 Favored 'General case' 0 CA--C 1.566 1.585 0 C-N-CA 124.078 0.951 . . . . 54.310000000000002 111.405 168.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.65 ' HG3' ' HB3' ' A' ' 109' ' ' TYR . 37.8 ttpt -73.78 -32.75 63.94 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.965 0.906 . . . . 73.319999999999993 111.872 173.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.83 -48.29 79.71 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 123.325 0.65 . . . . 73.519999999999996 110.623 174.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.3 m -75.63 -21.16 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 CA-C-N 116.178 -0.465 . . . . 41.509999999999998 111.801 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 43.9 t -67.17 -18.06 65.11 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.367 0.667 . . . . 72.409999999999997 111.463 170.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 87.37 -60.08 4.35 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 111.611 -0.595 . . . . 50.130000000000003 111.611 -177.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 47.6 t -156.65 92.73 1.32 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.586 0.755 . . . . 74.120000000000005 110.046 175.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.65 ' HB3' ' HG3' ' A' ' 103' ' ' LYS . 38.2 t80 -89.56 -63.65 1.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.978 0.511 . . . . 71.400000000000006 109.703 173.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 87.9 mt -132.93 108.0 8.65 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.582 0.753 . . . . 74.129999999999995 110.703 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -75.47 135.85 71.95 Favored Pre-proline 0 CA--C 1.564 1.507 0 C-N-CA 123.444 0.698 . . . . 73.530000000000001 111.903 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.09 94.76 0.96 Allowed 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.419 2.079 . . . . 72.129999999999995 113.074 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 49.4 mtm180 . . . . . 0 CA--C 1.561 1.4 0 C-N-CA 124.116 0.966 . . . . 60.439999999999998 109.992 175.078 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 120.491 0.186 . . . . 72.310000000000002 111.029 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 176.84 115.64 0.44 Allowed Glycine 0 C--N 1.347 1.16 0 CA-C-O 119.559 -0.579 . . . . 63.299999999999997 112.195 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 49.6 m -62.11 -62.02 2.07 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 117.221 0.511 . . . . 73.340000000000003 111.326 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -140.39 -65.83 0.45 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.072 0.549 . . . . 63.020000000000003 111.535 175.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.7 mp0 -64.95 -42.17 94.85 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.71 0.804 . . . . 73.230000000000004 111.056 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.4 mm-40 -64.75 -38.24 90.31 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 115.703 -0.68 . . . . 70.549999999999997 112.007 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -64.3 -50.0 69.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.621 0.368 . . . . 75.230000000000004 110.99 178.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.5 mm -60.71 -41.74 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 C-N-CA 123.635 0.774 . . . . 65.450000000000003 110.777 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -61.0 -46.46 90.69 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.818 0.847 . . . . 51.25 111.635 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -72.2 -43.59 64.26 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.241 0.617 . . . . 74.420000000000002 112.569 -178.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 9.8 p -65.36 -26.9 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 CA-C-N 118.287 0.494 . . . . 71.349999999999994 111.743 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 58.2 m -63.55 -40.38 96.85 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.636 0.774 . . . . 64.239999999999995 110.997 169.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 25.1 m-20 -76.28 -27.64 56.72 Favored 'General case' 0 CA--C 1.553 1.065 0 N-CA-C 113.044 0.757 . . . . 72.420000000000002 113.044 175.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -66.24 -30.62 71.1 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-O 121.183 0.516 . . . . 65.200000000000003 110.194 168.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.2 tt -69.21 -28.61 66.52 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.188 0.995 . . . . 75.209999999999994 111.147 172.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 32.8 mmtp -66.57 -43.31 85.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 122.031 -0.418 . . . . 75.450000000000003 111.229 174.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.07 -42.52 76.79 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.754 0.822 . . . . 75.409999999999997 110.684 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.471 HD21 ' HB ' ' A' ' 48' ' ' THR . 0.9 OUTLIER -56.07 -53.83 52.32 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 124.724 1.21 . . . . 72.310000000000002 111.699 175.974 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.452 ' HA ' HD21 ' A' ' 94' ' ' LEU . 81.2 mt -58.14 -42.98 84.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 123.817 0.847 . . . . 75.450000000000003 111.58 176.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -61.08 -51.08 70.66 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.889 0.876 . . . . 65.230000000000004 112.008 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.34 -44.82 90.29 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 122.967 0.507 . . . . 70.439999999999998 111.97 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.407 HG13 HG23 ' A' ' 42' ' ' ILE . 62.4 t -64.28 -48.82 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 CA-C-O 119.281 -0.39 . . . . 72.299999999999997 111.924 179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -56.99 -41.55 78.62 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 123.334 0.654 . . . . 74.239999999999995 112.483 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -70.92 -44.22 66.64 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 122.984 0.514 . . . . 74.219999999999999 110.447 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.561 ' O ' HG23 ' A' ' 29' ' ' VAL . 6.6 m-20 -61.14 -36.35 79.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.243 1.017 . . . . 74.5 111.96 174.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 51.7 mt -61.18 -40.01 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.67 0.788 . . . . 74.400000000000006 110.954 175.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -70.54 -29.65 66.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.746 0.419 . . . . 73.409999999999997 112.051 176.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -66.87 -32.34 73.54 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.894 0.478 . . . . 74.109999999999999 110.811 168.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 25' ' ' ASP . 20.2 t -76.3 -28.32 18.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 122.475 0.31 . . . . 72.430000000000007 111.398 173.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -65.58 -28.14 68.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.003 -1.061 . . . . 73.299999999999997 111.694 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -93.54 -16.16 24.72 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.521 0.563 . . . . 74.040000000000006 112.521 172.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -145.69 78.9 11.55 Favored Pre-proline 0 N--CA 1.49 1.543 0 C-N-CA 123.236 0.614 . . . . 74.010000000000005 109.879 178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.439 ' HA ' HG12 ' A' ' 29' ' ' VAL . 37.9 Cg_endo -62.17 -31.52 82.82 Favored 'Trans proline' 0 C--N 1.384 2.433 0 C-N-CA 123.03 2.487 . . . . 74.549999999999997 114.211 -172.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -85.02 0.12 52.54 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 112.923 0.712 . . . . 74.209999999999994 112.923 -173.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -72.58 104.02 3.74 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-O 121.507 0.67 . . . . 73.319999999999993 110.594 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 3.1 mmt -79.25 -21.5 46.06 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.924 0.89 . . . . 75.540000000000006 112.915 -173.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -69.73 -40.49 76.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.21 0.604 . . . . 64.209999999999994 111.489 175.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -64.87 -38.48 91.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.381 0.272 . . . . 72.030000000000001 111.195 175.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.452 ' CE2' HG11 ' A' ' 29' ' ' VAL . 33.1 m95 -70.45 -31.34 68.46 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.363 0.505 . . . . 74.349999999999994 112.363 172.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -65.66 -42.12 91.75 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.396 0.678 . . . . 73.409999999999997 110.462 175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.33 -54.55 42.44 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.658 0.783 . . . . 74.430000000000007 111.098 174.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.407 HG23 HG13 ' A' ' 22' ' ' VAL . 83.4 mt -54.48 -44.42 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 C-N-CA 124.183 0.993 . . . . 71.099999999999994 112.024 178.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -58.63 -46.3 87.38 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.853 0.861 . . . . 75.099999999999994 112.217 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.66 -41.16 96.29 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.342 0.657 . . . . 64.409999999999997 111.547 178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' MET . 91.0 mt -67.98 -36.9 80.81 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.376 0.67 . . . . 71.040000000000006 111.59 179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.565 HG13 HD12 ' A' ' 65' ' ' LEU . 56.0 t -68.56 -36.46 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.657 0.783 . . . . 62.310000000000002 111.427 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -60.16 -38.24 82.55 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.671 0.389 . . . . 43.310000000000002 110.863 172.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.471 ' HB ' HD21 ' A' ' 18' ' ' LEU . 31.8 m -66.31 -45.07 81.58 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 122.907 0.483 . . . . 71.209999999999994 110.985 175.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.3 mtt -56.59 -47.18 80.11 Favored 'General case' 0 N--CA 1.505 2.282 0 C-N-CA 123.416 0.686 . . . . 63.149999999999999 111.394 177.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.456 ' HE3' ' HD2' ' A' ' 66' ' ' HIS . 61.7 tttm -56.91 -50.35 72.83 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.519 -1.219 . . . . 71.439999999999998 111.12 175.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.46 -31.7 72.94 Favored 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 123.987 0.915 . . . . 74.530000000000001 112.32 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 48' ' ' THR . 83.4 mt -69.4 -50.01 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.427 0.691 . . . . 71.439999999999998 111.005 176.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.537 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 5.2 t -68.61 -28.47 66.95 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 112.299 0.481 . . . . 61.509999999999998 112.299 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 50' ' ' LYS . 54.4 mt-10 -69.84 -41.45 74.89 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 122.73 0.412 . . . . 65.0 111.934 176.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 13.2 t -70.8 -21.24 62.5 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 117.764 0.256 . . . . 64.030000000000001 111.278 175.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 63.7 mtt -80.64 -17.05 52.46 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.46 0.704 . . . . 73.209999999999994 111.917 170.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.63 9.62 58.62 Favored Glycine 0 N--CA 1.481 1.668 0 N-CA-C 114.411 0.524 . . . . 15.51 114.411 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.537 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 64.9 m-85 -94.03 95.02 8.76 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.972 0.909 . . . . 72.140000000000001 110.966 -179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.6 m -74.87 -27.69 60.35 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.054 0.542 . . . . 74.519999999999996 111.71 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 48.4 t -65.05 -43.69 91.49 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.034 0.933 . . . . 73.230000000000004 112.364 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 39.7 t -68.09 -46.12 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.995 -0.372 . . . . 73.030000000000001 109.995 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.5 -32.48 67.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.42 0.688 . . . . 54.240000000000002 112.313 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -63.27 -39.14 93.76 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.931 0.892 . . . . 65.450000000000003 111.328 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.56 -47.65 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 C-N-CA 123.188 0.595 . . . . 54.530000000000001 110.929 175.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.565 HD12 HG13 ' A' ' 46' ' ' VAL . 3.9 mm? -67.49 -28.16 67.61 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.97 0.508 . . . . 75.439999999999998 111.425 178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.456 ' HD2' ' HE3' ' A' ' 50' ' ' LYS . 57.5 t-80 -65.77 -29.09 69.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.974 0.909 . . . . 71.150000000000006 110.952 177.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.3 p -72.81 -37.81 67.41 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 110.254 -0.276 . . . . 54.25 110.254 175.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.435 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.9 mm -68.09 -34.72 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.528 0.731 . . . . 64.430000000000007 110.253 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 79.8 mmm -57.14 -53.86 53.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.614 -0.721 . . . . 60.229999999999997 110.422 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -62.53 -35.76 80.43 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.814 0.846 . . . . 74.329999999999998 112.073 -179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 tt -70.65 -58.64 3.45 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.327 1.051 . . . . 73.340000000000003 110.625 -175.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 87.0 t -67.3 -35.82 74.91 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.016 0.926 . . . . 73.120000000000005 112.481 -177.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -59.05 -37.44 77.03 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.153 0.581 . . . . 72.030000000000001 110.995 174.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -70.86 -32.18 69.1 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.537 0.735 . . . . 73.219999999999999 111.597 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 33.6 mtt -59.3 -40.49 86.35 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.607 0.363 . . . . 65.239999999999995 111.9 176.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.593 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.8 mp -56.62 -37.15 70.29 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 113.799 1.037 . . . . 70.219999999999999 113.799 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.552 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.4 OUTLIER -86.84 141.93 28.44 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.39 0.614 . . . . 74.310000000000002 112.233 -178.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 52.7 m -71.13 -5.93 35.42 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.91 1.284 . . . . 63.32 113.491 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.735 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.3 pt-20 -72.49 -15.61 61.8 Favored 'General case' 0 CA--C 1.559 1.305 0 CA-C-O 121.359 0.6 . . . . 62.32 110.932 174.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.735 HG12 ' HG3' ' A' ' 79' ' ' GLU . 14.7 mm -120.53 141.73 39.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 125.522 1.529 . . . . 71.420000000000002 109.931 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -107.44 135.1 49.49 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.323 0.649 . . . . 71.209999999999994 109.779 172.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.404 HD12 ' H ' ' A' ' 82' ' ' ILE . 4.1 mp -79.42 97.74 2.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 123.183 0.593 . . . . 62.32 109.432 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 90.1 m -75.42 136.67 40.71 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 115.056 -0.975 . . . . 74.519999999999996 111.051 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 35.5 t -59.66 -43.28 93.99 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 112.762 0.653 . . . . 73.219999999999999 112.762 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -76.82 -17.87 58.74 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 113.036 0.754 . . . . 72.310000000000002 113.036 176.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 27.0 tp -70.29 -33.95 72.17 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.004 0.43 . . . . 74.25 110.982 172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.444 HG12 ' HZ2' ' A' ' 39' ' ' TRP . 56.7 mt -58.66 -34.73 52.4 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.295 0 C-N-CA 123.61 0.764 . . . . 70.150000000000006 110.173 172.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -67.84 -28.52 67.63 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 115.576 -0.738 . . . . 71.409999999999997 112.498 176.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -64.48 -43.45 94.14 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.08 0.467 . . . . 53.109999999999999 110.235 175.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 24.5 t -61.64 -46.14 97.17 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 124.007 0.923 . . . . 73.420000000000002 111.063 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -65.82 -43.46 88.55 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 114.924 -1.035 . . . . 72.409999999999997 110.739 -177.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.06 -37.79 86.32 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.004 0.921 . . . . 74.310000000000002 112.038 -178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.431 ' O ' HG23 ' A' ' 97' ' ' VAL . 74.4 mmtt -70.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 115.602 -0.726 . . . . 64.319999999999993 112.014 178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' HA ' ' A' ' 19' ' ' ILE . 33.2 tp -79.26 -28.76 42.38 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 120.854 0.359 . . . . 73.129999999999995 111.261 174.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -58.56 -43.6 89.39 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.507 0.723 . . . . 75.230000000000004 110.171 167.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -60.08 -47.02 87.6 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 114.62 -1.173 . . . . 74.420000000000002 111.184 173.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 93' ' ' LYS . 72.0 t -57.98 -41.71 80.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 123.1 0.56 . . . . 73.109999999999999 112.19 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 89.2 m -63.0 -44.66 95.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.418 0.687 . . . . 71.420000000000002 111.055 174.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -68.71 -34.68 76.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.962 0.905 . . . . 71.439999999999998 111.358 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -76.65 -27.99 55.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.108 0.963 . . . . 65.409999999999997 110.917 178.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.459 HD22 ' HD3' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.43 -40.93 70.11 Favored 'General case' 0 CA--C 1.559 1.309 0 CA-C-O 121.496 0.665 . . . . 65.219999999999999 109.364 173.416 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -63.65 -41.88 98.18 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.466 0.706 . . . . 51.25 110.396 173.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -64.17 -50.75 66.91 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.733 1.213 . . . . 64.239999999999995 112.242 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.459 ' HD3' HD22 ' A' ' 101' ' ' LEU . 0.0 OUTLIER -57.27 -30.07 64.37 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 113.824 1.046 . . . . 70.329999999999998 113.824 -168.591 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 43.7 t -66.65 -39.49 83.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.243 0 C-N-CA 123.344 0.658 . . . . 73.409999999999997 111.241 178.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 70.2 m -112.16 16.53 20.09 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.812 0.845 . . . . 54.039999999999999 111.583 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.18 101.7 2.11 Favored Glycine 0 N--CA 1.473 1.129 0 CA-C-N 116.508 -0.314 . . . . 54.409999999999997 113.525 -173.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 59.8 m -70.43 160.9 31.51 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.403 0.681 . . . . 64.109999999999999 111.705 176.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 18.9 p90 -82.13 97.61 8.28 Favored 'General case' 0 CA--C 1.562 1.431 0 CA-C-O 121.615 0.722 . . . . 65.530000000000001 110.09 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.6 mp -81.34 138.76 35.64 Favored 'General case' 0 N--CA 1.484 1.26 0 O-C-N 121.778 -0.576 . . . . 65.319999999999993 110.895 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.5 m -61.84 153.68 71.06 Favored Pre-proline 0 CA--C 1.566 1.558 0 C-N-CA 123.453 0.701 . . . . 72.510000000000005 110.983 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -65.2 84.21 0.19 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 122.466 2.111 . . . . 71.239999999999995 112.113 179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 124.771 1.228 . . . . 74.299999999999997 110.185 -174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 110.459 -0.2 . . . . 65.530000000000001 110.459 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.62 125.52 37.25 Favored Glycine 0 CA--C 1.54 1.604 0 O-C-N 123.579 0.549 . . . . 73.140000000000001 113.347 -179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 t -73.04 78.16 1.21 Allowed 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.665 0.786 . . . . 61.039999999999999 111.07 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 m-70 -138.95 148.81 44.01 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.961 0.904 . . . . 63.240000000000002 111.243 -175.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -67.51 -29.11 68.44 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.562 0.745 . . . . 72.540000000000006 110.285 169.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -55.23 -37.91 67.79 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.671 1.188 . . . . 73.349999999999994 112.532 172.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -58.96 -48.25 82.2 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.443 0.697 . . . . 75.120000000000005 110.53 172.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 69.9 mt -60.16 -38.32 76.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 114.832 -1.076 . . . . 73.409999999999997 111.639 -177.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -62.36 -51.38 67.84 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.148 0.579 . . . . 65.129999999999995 111.585 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -67.12 -46.25 74.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 61.530000000000001 111.958 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.477 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 3.6 p -65.72 -20.68 27.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-N 115.13 -0.941 . . . . 72.049999999999997 112.323 -174.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 90.8 m -61.73 -46.08 91.16 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 123.829 0.852 . . . . 75.219999999999999 111.276 172.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -74.94 -38.69 61.68 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.761 0.424 . . . . 73.430000000000007 110.911 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.477 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 48.4 mt-10 -62.07 -26.66 68.4 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.431 0.692 . . . . 71.25 112.048 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.614 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.4 OUTLIER -60.54 -45.8 92.54 Favored 'General case' 0 CA--C 1.556 1.18 0 C-N-CA 123.483 0.713 . . . . 72.019999999999996 110.77 170.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.614 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.4 mptp? -66.15 -37.27 85.25 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.474 0.71 . . . . 74.420000000000002 111.791 177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -61.04 -46.94 88.67 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.657 0.742 . . . . 72.120000000000005 110.739 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 18' ' ' LEU . 4.8 tp -62.67 -45.57 92.2 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 114.315 -1.311 . . . . 72.439999999999998 110.687 -178.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.1 mt -62.03 -37.65 78.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.087 1.355 . . . . 72.120000000000005 111.93 175.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -62.58 -47.32 84.35 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.673 0.389 . . . . 64.329999999999998 111.123 176.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -63.6 -40.28 96.53 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.207 0.447 . . . . 70.0 112.207 178.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.457 HG13 HG23 ' A' ' 42' ' ' ILE . 94.4 t -64.09 -56.2 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.649 0.38 . . . . 70.430000000000007 110.787 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -54.11 -52.02 62.34 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.561 0.744 . . . . 73.120000000000005 111.966 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -58.45 -40.89 83.84 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 112.793 0.664 . . . . 75.230000000000004 112.793 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' HB3' HD11 ' A' ' 42' ' ' ILE . 1.4 m-20 -63.26 -50.76 68.88 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.789 0.436 . . . . 62.240000000000002 111.722 174.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.594 HG21 ' HG2' ' A' ' 91' ' ' LYS . 65.7 mt -58.02 -41.45 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.1 0.56 . . . . 73.439999999999998 110.908 178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -54.37 -36.15 63.57 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.253 1.021 . . . . 63.420000000000002 111.67 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -73.42 -40.49 64.2 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 116.061 -0.518 . . . . 72.319999999999993 111.6 172.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.606 HG11 ' NE1' ' A' ' 39' ' ' TRP . 2.9 t -73.01 -27.46 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 113.038 0.755 . . . . 51.109999999999999 113.038 -175.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 50.6 mt-10 -60.74 -33.86 73.56 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.648 -0.658 . . . . 75.319999999999993 110.489 176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -92.94 -28.13 16.64 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-N 114.851 -1.068 . . . . 75.25 111.477 178.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -127.72 76.24 77.32 Favored Pre-proline 0 N--CA 1.495 1.817 0 C-N-CA 124.428 1.091 . . . . 71.099999999999994 110.05 -179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -82.42 43.45 1.5 Allowed 'Trans proline' 0 C--N 1.387 2.554 0 C-N-CA 123.764 2.976 . . . . 74.400000000000006 114.766 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -140.16 -22.03 0.85 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 113.106 0.78 . . . . 73.030000000000001 113.106 -178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -64.17 89.99 0.06 Allowed 'General case' 0 CA--C 1.552 1.036 0 CA-C-O 121.374 0.607 . . . . 72.409999999999997 111.115 178.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 9.0 mmt -64.54 -28.1 69.42 Favored 'General case' 0 C--O 1.21 -1.021 0 CA-C-N 115.002 -0.999 . . . . 71.439999999999998 110.229 177.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.6 mp0 -56.41 -42.16 77.54 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 125.243 1.417 . . . . 70.549999999999997 112.087 173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.7 m-30 -64.44 -44.79 90.04 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.673 0.389 . . . . 64.030000000000001 110.353 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.606 ' NE1' HG11 ' A' ' 29' ' ' VAL . 53.4 m95 -65.99 -29.4 69.77 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.152 0.797 . . . . 73.519999999999996 113.152 177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -65.2 -46.46 80.63 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.054 0.542 . . . . 73.430000000000007 109.628 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -59.5 -54.36 47.44 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.506 -1.224 . . . . 75.409999999999997 111.625 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.515 HD11 ' HB3' ' A' ' 25' ' ' ASP . 95.5 mt -54.57 -36.82 36.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 123.594 0.758 . . . . 72.030000000000001 111.567 178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.44 -49.23 64.61 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.391 0.676 . . . . 74.420000000000002 111.338 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -26.05 62.96 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.779 0.659 . . . . 64.109999999999999 112.779 178.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 73.7 mt -68.07 -48.32 65.9 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.567 0.747 . . . . 71.329999999999998 110.4 173.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.54 HG13 HD12 ' A' ' 65' ' ' LEU . 67.5 t -71.67 -27.84 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.171 0.989 . . . . 63.140000000000001 111.374 176.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -63.63 -40.11 96.04 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 123.827 0.851 . . . . 73.430000000000007 109.796 171.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 56.3 m -66.75 -43.97 82.71 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 115.301 -0.863 . . . . 75.340000000000003 110.048 175.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.7 mtt -58.86 -40.96 85.89 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.189 0.596 . . . . 71.430000000000007 112.048 176.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.43 -54.94 32.83 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.142 0.977 . . . . 70.439999999999998 110.799 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.73 -30.94 71.68 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.929 0.491 . . . . 71.340000000000003 112.138 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 53.4 mt -60.89 -57.35 12.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 123.459 0.704 . . . . 73.219999999999999 110.925 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 9.6 t -67.35 -28.44 67.96 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 111.885 0.328 . . . . 64.5 111.885 -178.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -71.51 -34.51 70.16 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.035 0.534 . . . . 74.530000000000001 112.298 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.2 t -80.86 -21.26 40.85 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.091 0.405 . . . . 74.219999999999999 111.247 174.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.6 mtp -79.66 -12.89 59.8 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.372 0.669 . . . . 74.310000000000002 111.198 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 6.91 64.67 Favored Glycine 0 N--CA 1.48 1.572 0 N-CA-C 114.769 0.667 . . . . 75.239999999999995 114.769 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.412 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 94.1 m-85 -94.83 80.22 3.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.321 1.049 . . . . 72.439999999999998 111.46 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 84.6 p -68.21 -24.69 64.97 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.881 -0.512 . . . . 73.439999999999998 111.208 176.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 23.0 m -59.98 -44.0 94.77 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.214 1.006 . . . . 75.099999999999994 112.033 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 46.7 t -72.03 -38.75 64.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 110.223 178.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -57.32 -35.92 70.48 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.353 0.661 . . . . 51.43 112.293 177.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -58.09 -37.05 73.77 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 123.796 0.838 . . . . 70.549999999999997 112.287 174.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 48.1 t -69.3 -49.18 63.15 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 123.194 0.597 . . . . 73.129999999999995 110.572 178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.54 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.97 -29.82 69.77 Favored 'General case' 0 N--CA 1.497 1.891 0 C-N-CA 123.447 0.699 . . . . 63.140000000000001 111.789 178.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -63.38 -27.6 69.42 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 124.071 0.948 . . . . 73.329999999999998 111.467 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 34.1 p -71.72 -36.96 70.65 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 116.838 -0.164 . . . . 63.219999999999999 111.059 178.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.468 HG21 HG21 ' A' ' 46' ' ' VAL . 4.1 mp -65.1 -39.65 86.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.907 0.483 . . . . 32.32 110.225 174.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 69.0 mmm -58.2 -54.34 48.14 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.194 0.598 . . . . 40.149999999999999 111.41 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.11 -39.16 85.26 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.674 0.79 . . . . 74.340000000000003 110.656 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.9 tt -59.4 -52.21 66.6 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 114.35 -1.296 . . . . 60.520000000000003 110.762 -179.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 ' HB3' ' A' ' 39' ' ' TRP . 57.4 t -70.78 -35.68 61.41 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.205 0 CA-C-N 115.594 -0.73 . . . . 73.010000000000005 111.36 -178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -53.2 -41.25 65.1 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.925 0.89 . . . . 63.149999999999999 111.886 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.693 ' HB3' HG21 ' A' ' 80' ' ' ILE . 89.9 mttt -73.4 -47.81 38.97 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.729 0.641 . . . . 73.540000000000006 112.729 -179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.698 ' HB3' HG13 ' A' ' 82' ' ' ILE . 42.9 mtm -67.69 -29.69 69.02 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.322 0.49 . . . . 52.310000000000002 112.322 -177.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.478 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 33.2 tp -50.01 -34.15 20.32 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 125.065 1.346 . . . . 71.239999999999995 111.977 172.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.46 HD22 ' HG2' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -104.85 126.06 51.53 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.693 0.797 . . . . 44.119999999999997 110.699 171.593 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.5 t -67.15 -3.99 9.06 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 124.835 1.254 . . . . 64.019999999999996 113.715 -175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.64 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -66.32 -28.93 69.06 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 121.628 0.728 . . . . 62.140000000000001 110.557 175.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.693 HG21 ' HB3' ' A' ' 74' ' ' LYS . 9.8 mm -95.25 -42.45 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 124.867 1.267 . . . . 74.400000000000006 109.9 177.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.5 tttt 72.64 153.18 0.13 Allowed 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 125.543 1.537 . . . . 72.239999999999995 112.19 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.698 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.3 mp -90.56 98.38 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.039 0.936 . . . . 72.209999999999994 109.966 -170.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 89.6 m -79.34 129.56 34.58 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.784 -0.644 . . . . 75.299999999999997 110.24 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 37.3 t -61.87 -38.06 86.88 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.288 0.635 . . . . 75.239999999999995 112.516 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -69.02 -29.08 67.17 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.275 0.63 . . . . 63.520000000000003 111.653 175.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.42 ' HG ' HD21 ' A' ' 71' ' ' LEU . 16.5 tp -76.13 -33.95 59.44 Favored 'General case' 0 CA--C 1.555 1.15 0 CA-C-N 116.153 -0.476 . . . . 63.119999999999997 111.454 175.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 61.2 mt -59.13 -34.98 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 CA-C-O 121.713 0.768 . . . . 51.130000000000003 109.465 168.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.85 -28.76 65.94 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-N 114.844 -1.071 . . . . 72.530000000000001 110.864 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -66.44 -38.57 87.68 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.591 0.356 . . . . 73.439999999999998 110.651 173.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.422 HG13 HG23 ' A' ' 68' ' ' ILE . 17.6 t -60.9 -49.23 85.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 122.86 0.464 . . . . 65.120000000000005 110.205 175.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.594 ' HG2' HG21 ' A' ' 26' ' ' ILE . 20.2 mmtp -54.13 -48.58 70.66 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.066 -0.97 . . . . 72.040000000000006 112.361 175.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -72.83 -40.55 65.69 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 123.488 0.715 . . . . 74.109999999999999 112.731 -172.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.421 ' O ' HG23 ' A' ' 97' ' ' VAL . 73.9 mmtt -66.14 -40.49 90.67 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.412 0.685 . . . . 73.530000000000001 111.541 175.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -75.31 -27.72 59.4 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.477 0.711 . . . . 73.530000000000001 110.317 178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.64 -43.74 93.74 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.902 0.881 . . . . 65.450000000000003 109.357 172.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 100' ' ' GLU . 23.7 ttt -63.56 -45.1 92.03 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.721 -1.582 . . . . 73.010000000000005 111.772 174.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 93' ' ' LYS . 88.4 t -59.45 -37.48 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 CA-C-N 118.333 0.515 . . . . 55.130000000000003 111.993 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 m -62.2 -49.47 75.66 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 115.666 -0.697 . . . . 62.450000000000003 110.179 170.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -58.4 -34.18 70.46 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.872 1.269 . . . . 75.239999999999995 112.716 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 96' ' ' MET . 13.6 mm-40 -63.09 -43.49 98.36 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.341 0.657 . . . . 55.219999999999999 111.702 -176.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.09 -43.06 65.39 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 122.678 0.391 . . . . 72.430000000000007 110.399 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -67.05 -25.87 66.47 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.043 0.537 . . . . 64.540000000000006 112.28 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -76.25 -36.58 58.41 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.176 0.991 . . . . 74.109999999999999 110.402 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.8 tttm -59.74 -37.04 77.88 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.616 0.766 . . . . 71.409999999999997 111.159 172.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.7 t -69.35 -68.32 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.229 0 C-N-CA 123.168 0.587 . . . . 74.150000000000006 109.85 171.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 69.0 m -151.09 -70.04 0.17 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.218 1.007 . . . . 62.409999999999997 109.824 174.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.09 -94.04 0.17 Allowed Glycine 0 C--N 1.354 1.548 0 CA-C-N 115.984 -0.553 . . . . 62.130000000000003 113.765 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t 67.6 171.62 0.27 Allowed 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.459 1.504 . . . . 74.329999999999998 113.518 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -140.5 84.44 1.95 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 124.382 1.073 . . . . 72.25 110.149 -177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.0 tt -73.97 106.55 5.72 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.822 -0.548 . . . . 54.109999999999999 109.66 -177.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.7 m -96.98 143.03 25.42 Favored Pre-proline 0 CA--C 1.563 1.457 0 C-N-CA 123.774 0.83 . . . . 71.340000000000003 110.644 178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -78.86 -1.56 11.7 Favored 'Trans proline' 0 C--N 1.377 2.045 0 C-N-CA 122.521 2.148 . . . . 73.209999999999994 113.845 177.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 . . . . . 0 CA--C 1.571 1.776 0 C-N-CA 123.922 0.889 . . . . 60.149999999999999 111.114 178.138 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.3 ttm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 110.585 -0.154 . . . . 60.340000000000003 110.585 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.27 71.14 2.5 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.178 0.299 . . . . 54.329999999999998 112.577 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -82.23 136.59 35.06 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.719 0.808 . . . . 74.230000000000004 111.352 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -131.73 144.31 50.88 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.604 0.761 . . . . 50.219999999999999 110.334 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -68.37 -34.55 76.26 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.704 0.402 . . . . 75.219999999999999 111.167 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -60.49 -35.37 75.78 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.201 0.6 . . . . 65.400000000000006 111.873 176.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -57.63 -52.28 66.06 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.157 0.583 . . . . 72.019999999999996 110.176 170.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.557 HG23 ' SD ' ' A' ' 56' ' ' MET . 62.2 mt -57.68 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.916 0.886 . . . . 65.239999999999995 111.052 178.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -71.52 -32.76 68.54 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 123.895 0.878 . . . . 61.43 112.304 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -73.2 -51.06 19.17 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.217 0.462 . . . . 70.510000000000005 110.752 175.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.555 ' HA ' ' HB2' ' A' ' 14' ' ' GLU . 30.1 m -64.24 -17.83 21.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.14 0.576 . . . . 72.219999999999999 112.388 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 45.8 m -58.04 -49.34 77.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.911 0.484 . . . . 70.420000000000002 111.189 165.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -75.48 -35.54 60.82 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.263 0.625 . . . . 64.239999999999995 112.001 177.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 11' ' ' VAL . 42.4 mt-10 -69.77 -26.06 64.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.733 0.813 . . . . 74.409999999999997 111.198 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -56.26 -45.27 80.14 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.968 0.907 . . . . 74.540000000000006 110.706 167.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.504 ' HD2' HD23 ' A' ' 15' ' ' LEU . 5.2 mptp? -62.82 -40.5 97.59 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.222 0.609 . . . . 75.239999999999995 112.074 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.2 -47.52 85.02 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.899 0.857 . . . . 74.340000000000003 110.475 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.485 HD12 ' HA ' ' A' ' 18' ' ' LEU . 5.3 tp -64.83 -50.51 66.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 113.859 -1.519 . . . . 75.329999999999998 111.016 -175.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.438 HG23 ' HG ' ' A' ' 94' ' ' LEU . 81.3 mt -59.14 -47.85 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 123.955 0.902 . . . . 74.099999999999994 111.802 176.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -59.81 -48.22 82.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.078 0.551 . . . . 61.240000000000002 112.118 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -57.76 -54.4 47.35 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 123.557 0.536 . . . . 71.430000000000007 110.875 175.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 26' ' ' ILE . 97.8 t -60.19 -36.27 67.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.285 0.634 . . . . 73.209999999999994 111.781 -179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -65.57 -39.08 91.25 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.185 0.994 . . . . 62.25 110.121 -174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -77.95 -32.35 51.41 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 114.948 -1.023 . . . . 71.549999999999997 111.077 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.28 -42.95 87.69 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.289 0.635 . . . . 50.200000000000003 112.482 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 22' ' ' VAL . 47.6 mt -64.2 -31.04 51.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 122.958 0.503 . . . . 62.009999999999998 110.359 177.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 63.8 mttp -67.6 -35.53 79.14 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.028 0.531 . . . . 75.049999999999997 111.645 173.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -67.37 -29.69 69.28 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 122.626 0.37 . . . . 74.230000000000004 110.625 172.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.578 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 44.2 t -72.98 -27.13 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.402 0 C-N-CA 122.455 0.302 . . . . 73.540000000000006 111.573 174.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' HA ' ' A' ' 27' ' ' LYS . 34.3 mt-10 -57.27 -31.79 65.94 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.36 -0.837 . . . . 42.210000000000001 110.637 171.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -80.88 -43.38 20.0 Favored 'General case' 0 CA--C 1.559 1.308 0 CA-C-N 114.946 -1.025 . . . . 75.510000000000005 110.855 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -125.06 84.14 59.55 Favored Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 124.362 1.065 . . . . 70.239999999999995 110.872 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.65 -52.75 4.09 Favored 'Trans proline' 0 C--N 1.387 2.587 0 C-N-CA 123.511 2.807 . . . . 71.319999999999993 114.934 -169.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.402 ' HA ' HD12 ' A' ' 82' ' ' ILE . 45.8 mt-10 -91.04 25.17 2.54 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.153 0.581 . . . . 72.329999999999998 112.443 -173.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -74.13 89.46 1.99 Allowed 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 109.074 -0.713 . . . . 73.109999999999999 109.074 175.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.4 mmt -64.66 -35.54 81.36 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.4 0.68 . . . . 72.019999999999996 111.984 -173.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.492 ' HA ' HD22 ' A' ' 40' ' ' ASN . 41.2 tt0 -55.88 -46.82 78.21 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.226 0.61 . . . . 53.020000000000003 111.377 176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.63 -36.44 84.24 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.696 -0.684 . . . . 73.5 111.236 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.578 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.9 m95 -70.96 -27.49 63.78 Favored 'General case' 0 CA--C 1.553 1.087 0 N-CA-C 113.002 0.741 . . . . 74.329999999999998 113.002 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.492 HD22 ' HA ' ' A' ' 37' ' ' GLU . 58.1 m-80 -60.83 -46.49 90.36 Favored 'General case' 0 N--CA 1.497 1.882 0 CA-C-N 118.962 0.801 . . . . 75.209999999999994 110.222 170.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -54.94 -55.55 29.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 123.653 0.596 . . . . 75.239999999999995 111.132 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.417 HG23 HG13 ' A' ' 22' ' ' VAL . 94.6 mt -62.18 -37.86 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 C-N-CA 123.406 0.682 . . . . 71.25 111.864 -176.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -65.16 -46.7 79.8 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.009 0.524 . . . . 74.129999999999995 111.392 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -66.12 -38.6 88.6 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.299 0.64 . . . . 74.450000000000003 111.747 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' A' ' 49' ' ' MET . 94.4 mt -68.26 -42.0 80.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.26 0.624 . . . . 75.439999999999998 111.747 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.612 HG11 ' HB ' ' A' ' 68' ' ' ILE . 45.7 t -68.23 -34.7 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 C-N-CA 123.321 0.649 . . . . 75.319999999999993 111.445 174.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -62.22 -37.07 83.95 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.548 0.739 . . . . 65.230000000000004 109.647 175.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.4 m -66.63 -48.11 70.51 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.695 -0.684 . . . . 71.120000000000005 110.621 174.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.443 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 60.5 mtt -55.21 -45.87 75.9 Favored 'General case' 0 N--CA 1.501 2.075 0 C-N-CA 123.781 0.833 . . . . 64.299999999999997 111.254 178.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.517 ' HD2' ' HG3' ' A' ' 69' ' ' MET . 60.0 tttm -55.38 -53.38 56.94 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.903 1.281 . . . . 73.25 111.075 176.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -63.72 -32.63 74.19 Favored 'General case' 0 CA--C 1.566 1.561 0 C-N-CA 123.597 0.759 . . . . 74.319999999999993 112.087 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.411 ' O ' HG22 ' A' ' 55' ' ' THR . 66.6 mt -67.7 -51.2 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.623 0.769 . . . . 74.310000000000002 111.235 177.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.554 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -67.5 -34.29 76.84 Favored 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 112.316 0.487 . . . . 52.439999999999998 112.316 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -70.56 -34.7 72.53 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 112.417 0.525 . . . . 64.439999999999998 112.417 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 52' ' ' ILE . 8.2 t -72.62 -25.93 61.49 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 117.977 0.353 . . . . 62.210000000000001 111.3 175.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.557 ' SD ' HG23 ' A' ' 8' ' ' ILE . 69.6 mtm -82.96 -19.23 37.54 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.944 0.498 . . . . 63.32 111.756 173.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.56 35.18 8.03 Favored Glycine 0 CA--C 1.54 1.597 0 N-CA-C 114.415 0.526 . . . . 63.039999999999999 114.415 175.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.554 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 87.8 m-85 -106.15 102.55 11.96 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.01 0.924 . . . . 74.219999999999999 110.772 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.6 m -74.29 -32.28 62.84 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.932 0.493 . . . . 54.329999999999998 111.44 177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.0 t -61.84 -48.88 78.58 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.604 0.762 . . . . 73.230000000000004 111.435 -179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.66 HG22 ' HG2' ' A' ' 100' ' ' GLU . 17.1 t -67.69 -49.62 68.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.016 0 CA-C-N 115.912 -0.586 . . . . 63.229999999999997 109.753 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -53.81 -38.97 65.11 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 113.393 0.886 . . . . 72.019999999999996 113.393 -175.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 88.8 tttt -63.23 -40.91 98.81 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.427 0.455 . . . . 74.319999999999993 111.469 179.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.62 -45.62 97.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 123.092 0.557 . . . . 60.340000000000003 110.916 178.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.593 HD12 HG13 ' A' ' 46' ' ' VAL . 3.3 mm? -71.74 -31.27 66.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.052 0.541 . . . . 50.109999999999999 110.917 177.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 50.6 t-80 -65.07 -29.22 70.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.913 0.885 . . . . 62.119999999999997 110.878 178.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.466 HG23 ' O ' ' A' ' 63' ' ' LYS . 21.5 p -72.63 -35.8 67.88 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 116.726 -0.216 . . . . 74.019999999999996 110.522 175.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.612 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.9 mm -74.34 -34.02 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 123.387 0.675 . . . . 44.329999999999998 110.612 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.517 ' HG3' ' HD2' ' A' ' 50' ' ' LYS . 69.1 mmm -57.36 -49.39 76.3 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.641 0.776 . . . . 74.549999999999997 110.374 172.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -63.78 -40.58 97.0 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.422 -0.808 . . . . 74.340000000000003 111.247 176.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 tt -67.13 -59.24 3.61 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.934 0.894 . . . . 63.310000000000002 111.139 -173.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 38.5 t -68.68 -32.55 55.49 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 123.896 0.878 . . . . 41.329999999999998 112.549 -176.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -58.7 -41.3 85.94 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.222 0.534 . . . . 72.299999999999997 110.742 173.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -68.62 -28.9 67.32 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.631 0.772 . . . . 63.200000000000003 112.145 174.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.503 ' HB3' HD11 ' A' ' 82' ' ' ILE . 27.7 mtt -66.89 -43.53 83.2 Favored 'General case' 0 CA--C 1.557 1.248 0 N-CA-C 112.744 0.646 . . . . 64.329999999999998 112.744 177.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.4 -13.51 1.47 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 115.946 1.832 . . . . 64.200000000000003 115.946 -170.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -99.62 163.25 12.57 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-O 121.514 0.674 . . . . 74.25 112.769 -178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 51.2 m -73.01 -12.87 61.09 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.782 0.833 . . . . 54.409999999999997 111.534 169.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -65.97 -37.25 85.49 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 125.122 1.369 . . . . 73.230000000000004 112.519 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.0 mm -120.71 143.21 33.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 124.423 1.089 . . . . 75.310000000000002 110.078 -170.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -106.98 152.17 24.32 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.403 0.681 . . . . 45.32 111.185 178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 75' ' ' MET . 80.3 mt -107.46 107.43 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 123.732 0.813 . . . . 72.319999999999993 111.01 -174.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 85' ' ' ASP . 89.8 m -80.52 148.54 30.37 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.31 -0.859 . . . . 72.120000000000005 110.224 173.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 44.2 t -57.52 -38.57 74.87 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.277 0.631 . . . . 61.530000000000001 111.964 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.523 ' H ' HG22 ' A' ' 83' ' ' THR . 1.9 m-20 -65.02 -30.94 71.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.539 0.736 . . . . 63.130000000000003 111.925 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 22.9 tp -72.96 -34.6 66.59 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.84 0.456 . . . . 74.200000000000003 111.112 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 71.1 mt -60.8 -32.72 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.434 0.694 . . . . 72.200000000000003 110.213 171.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -69.63 -29.7 67.25 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.757 -0.656 . . . . 72.230000000000004 111.173 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -66.19 -36.64 83.6 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.067 0.46 . . . . 62.219999999999999 110.353 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 6.7 t -71.18 -43.26 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 CA-C-N 115.412 -0.813 . . . . 52.409999999999997 110.754 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -59.72 -52.82 63.84 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.765 0.654 . . . . 63.210000000000001 112.765 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.427 ' HE3' HH12 ' A' ' 99' ' ' ARG . 20.4 tptm -68.64 -36.8 79.08 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.321 0.489 . . . . 63.409999999999997 112.321 -169.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.43 ' CB ' HD11 ' A' ' 68' ' ' ILE . 0.0 OUTLIER -60.85 -41.22 95.44 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.545 0.338 . . . . 74.329999999999998 111.23 174.133 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' HG ' HG23 ' A' ' 19' ' ' ILE . 32.3 tp -66.89 -39.12 87.36 Favored 'General case' 0 CA--C 1.558 1.264 0 CA-C-O 121.318 0.58 . . . . 74.230000000000004 111.311 178.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.0 -35.35 78.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.886 0.874 . . . . 75.030000000000001 111.909 172.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 11.8 tpt -69.8 -29.4 66.69 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.126 0.97 . . . . 73.510000000000005 111.714 176.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 93' ' ' LYS . 48.7 t -63.73 -40.33 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 CA-C-O 121.416 0.627 . . . . 74.140000000000001 110.48 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 90.6 m -66.35 -49.64 66.26 Favored 'General case' 0 CA--C 1.555 1.173 0 CA-C-N 115.223 -0.899 . . . . 71.209999999999994 110.998 174.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.427 HH12 ' HE3' ' A' ' 92' ' ' LYS . 86.2 mtt180 -67.66 -24.23 65.41 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.858 0.863 . . . . 75.540000000000006 112.984 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.66 ' HG2' HG22 ' A' ' 61' ' ' VAL . 18.4 tp10 -58.87 -46.77 87.0 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.795 0.838 . . . . 65.239999999999995 110.874 174.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 105' ' ' VAL . 59.7 tp -70.99 -34.2 71.15 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.607 -0.724 . . . . 73.340000000000003 111.161 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.66 -54.34 48.16 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.797 0.839 . . . . 71.099999999999994 111.357 178.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -72.98 -18.44 61.36 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.33 0.652 . . . . 74.129999999999995 112.042 177.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -67.42 -41.72 84.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.004 0.522 . . . . 75.150000000000006 111.058 173.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 101' ' ' LEU . 87.6 t -63.83 -32.0 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.271 0 C-N-CA 123.462 0.705 . . . . 42.200000000000003 110.955 175.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.0 m -64.32 152.69 40.53 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.125 0.57 . . . . 75.209999999999994 112.002 177.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.52 -84.6 0.49 Allowed Glycine 0 N--CA 1.476 1.346 0 CA-C-N 116.101 -0.5 . . . . 72.450000000000003 112.23 -179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.7 t -171.77 -59.16 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.692 0.797 . . . . 72.519999999999996 111.361 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 67.6 t80 74.69 -31.35 0.21 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.855 1.662 . . . . 75.239999999999995 113.053 -173.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 10.1 mp -62.97 -47.02 84.98 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.295 0.638 . . . . 71.140000000000001 110.833 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.8 m -102.69 115.77 63.76 Favored Pre-proline 0 CA--C 1.564 1.492 0 C-N-CA 123.193 0.597 . . . . 33.520000000000003 110.839 175.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -80.19 165.36 21.43 Favored 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.85 2.367 . . . . 75.439999999999998 112.194 170.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? . . . . . 0 N--CA 1.497 1.886 0 C-N-CA 125.072 1.349 . . . . 73.299999999999997 112.303 177.13 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.493 1.692 0 N-CA-C 110.556 -0.164 . . . . 54.009999999999998 110.556 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.97 121.04 1.21 Allowed Glycine 0 C--N 1.35 1.338 0 CA-C-O 120.011 -0.327 . . . . 71.519999999999996 113.365 -178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.2 t -91.75 171.69 8.98 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.575 0.75 . . . . 73.099999999999994 110.813 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -87.3 100.79 12.97 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 63.340000000000003 111.127 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -70.03 -30.92 68.32 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.231 0.612 . . . . 74.150000000000006 111.782 178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.518 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 14.3 tp10 -62.71 -32.65 73.79 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.412 0.685 . . . . 61.340000000000003 111.481 176.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -68.04 -42.89 79.88 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.73 0.812 . . . . 70.439999999999998 110.813 173.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.9 mm -60.61 -43.02 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.18 0.592 . . . . 42.350000000000001 110.933 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.518 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 48.5 mtpt -59.8 -43.17 94.6 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.855 0.862 . . . . 73.239999999999995 111.328 171.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 14' ' ' GLU . 3.4 tppt? -63.03 -51.72 65.66 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 115.64 -0.709 . . . . 62.299999999999997 111.071 -173.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 80.8 t -59.91 -26.25 35.11 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.457 0 C-N-CA 124.434 1.094 . . . . 44.119999999999997 112.344 -176.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 38.6 m -67.66 -42.11 82.72 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 123.237 0.615 . . . . 61.340000000000003 111.119 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -77.56 -31.38 53.19 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.506 0.722 . . . . 65.329999999999998 111.98 177.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 40.9 mt-10 -68.23 -30.1 69.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.468 0.707 . . . . 72.019999999999996 110.169 174.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.453 HD21 HG12 ' A' ' 97' ' ' VAL . 5.3 tt -61.52 -37.67 84.59 Favored 'General case' 0 CA--C 1.559 1.291 0 C-N-CA 124.585 1.154 . . . . 73.109999999999999 110.876 169.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -67.48 -46.56 72.61 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 122.959 0.504 . . . . 65.209999999999994 111.457 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -57.68 -32.04 66.95 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 124.402 1.081 . . . . 71.519999999999996 111.334 175.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.525 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.2 tp -75.69 -47.81 24.65 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.668 -1.151 . . . . 72.040000000000006 111.195 -176.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.2 mt -56.39 -38.71 56.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.918 0.887 . . . . 74.519999999999996 111.13 173.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 tm0? -68.03 -50.55 54.7 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.677 0.791 . . . . 71.109999999999999 111.191 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.25 -47.23 86.87 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.039 0.536 . . . . 73.209999999999994 111.999 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.592 HG13 HG23 ' A' ' 42' ' ' ILE . 58.6 t -61.45 -44.22 98.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.716 -0.674 . . . . 75.030000000000001 111.574 177.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -36.13 76.34 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 122.627 0.371 . . . . 62.119999999999997 110.606 177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.756 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 37.8 t70 -70.96 -36.93 72.75 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.967 0.907 . . . . 64.430000000000007 111.491 178.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -68.62 -36.9 79.26 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.187 0.595 . . . . 75.409999999999997 111.256 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.48 HG21 ' HG2' ' A' ' 91' ' ' LYS . 82.4 mt -64.44 -35.98 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.66 0.784 . . . . 63.140000000000001 111.037 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.756 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 46.6 mtpt -52.88 -37.03 60.04 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.594 0.758 . . . . 75.530000000000001 112.167 175.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -76.81 -26.38 54.34 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.532 0.733 . . . . 74.530000000000001 112.278 177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.551 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 24.6 t -77.76 -35.66 21.47 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.396 0 CA-C-O 121.117 0.484 . . . . 71.200000000000003 111.462 174.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -61.48 -22.43 65.08 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.74 0.816 . . . . 63.109999999999999 110.244 172.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -87.23 -43.09 12.47 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 124.806 1.242 . . . . 70.439999999999998 111.162 173.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -139.59 90.05 11.49 Favored Pre-proline 0 N--CA 1.495 1.79 0 C-N-CA 124.86 1.264 . . . . 70.140000000000001 111.043 -176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -65.06 -43.95 10.6 Favored 'Trans proline' 0 C--N 1.381 2.253 0 C-N-CA 123.351 2.701 . . . . 53.350000000000001 115.199 -172.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -81.33 1.61 31.93 Favored 'General case' 0 N--CA 1.491 1.623 0 N-CA-C 112.939 0.718 . . . . 74.430000000000007 112.939 -173.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -75.5 92.24 2.86 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-O 122.036 0.922 . . . . 74.519999999999996 110.903 177.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 9.5 mmt -68.23 -31.23 70.58 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 114.418 -1.264 . . . . 75.450000000000003 113.467 -170.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HA ' ' ND2' ' A' ' 40' ' ' ASN . 8.7 tp10 -58.28 -38.29 76.71 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.425 0.69 . . . . 64.129999999999995 111.765 177.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -74.08 -28.34 61.33 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 112.449 0.537 . . . . 75.140000000000001 112.449 175.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.551 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 52.6 m95 -71.3 -27.43 63.4 Favored 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 119.327 -0.368 . . . . 63.210000000000001 111.879 170.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.481 ' ND2' ' HA ' ' A' ' 37' ' ' GLU . 85.1 m-20 -62.45 -43.06 99.72 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 122.897 0.479 . . . . 64.109999999999999 110.805 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.434 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 3.8 mmmp? -51.66 -55.69 17.96 Favored 'General case' 0 N--CA 1.495 1.821 0 CA-C-N 115.83 -0.623 . . . . 74.530000000000001 111.039 171.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.592 HG23 HG13 ' A' ' 22' ' ' VAL . 95.8 mt -63.38 -48.36 87.61 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 C-N-CA 123.953 0.901 . . . . 74.430000000000007 112.085 -177.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -59.71 -46.7 88.31 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.071 0.949 . . . . 70.040000000000006 112.718 -173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 28.0 mtm180 -70.54 -27.56 64.25 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.527 0.566 . . . . 72.299999999999997 112.527 -178.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.0 mt -77.74 -36.55 50.67 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.756 0.422 . . . . 71.540000000000006 111.323 174.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.14 -28.7 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.295 0.638 . . . . 74.019999999999996 110.722 173.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -55.79 -44.38 77.71 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.839 0.855 . . . . 75.219999999999999 110.421 168.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.525 ' HB ' HD21 ' A' ' 18' ' ' LEU . 89.9 m -68.68 -42.18 78.17 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.293 -0.867 . . . . 71.420000000000002 111.019 178.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.3 mtt -56.79 -50.17 73.11 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 123.337 0.655 . . . . 73.120000000000005 111.816 176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HG3' ' A' ' 69' ' ' MET . 14.7 ttpp -53.52 -51.39 62.97 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.847 1.259 . . . . 73.420000000000002 110.953 174.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -63.33 -34.55 77.95 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 124.164 0.985 . . . . 70.340000000000003 111.964 -179.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.27 -57.81 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 124.327 1.051 . . . . 70.019999999999996 110.857 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.418 ' OG1' ' HB ' ' A' ' 61' ' ' VAL . 6.9 t -67.81 -29.78 69.04 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.537 0.569 . . . . 74.310000000000002 112.537 -174.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -64.88 -48.29 74.78 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.927 0.491 . . . . 73.439999999999998 111.469 172.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 t -73.47 -22.93 60.04 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 111.996 0.369 . . . . 71.299999999999997 111.996 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 45.0 mtt -75.71 -17.32 59.97 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.479 0.712 . . . . 64.129999999999995 112.357 173.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.26 8.58 77.93 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-N 116.912 -0.131 . . . . 74.109999999999999 113.35 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -86.64 55.14 3.42 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.067 0.947 . . . . 75.430000000000007 109.77 175.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 43.1 m -55.85 -32.13 63.35 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.123 0.969 . . . . 61.109999999999999 112.738 -175.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.5 m -64.27 -36.44 84.1 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.558 0.743 . . . . 53.520000000000003 112.267 176.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.418 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 23.9 t -71.78 -36.67 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 122.991 0.516 . . . . 64.150000000000006 110.11 174.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.35 -31.99 68.12 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.507 0.723 . . . . 62.25 112.525 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.436 ' O ' HG23 ' A' ' 67' ' ' THR . 14.3 mptt -53.06 -47.08 68.72 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 122.879 0.472 . . . . 73.510000000000005 111.175 170.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.37 -55.64 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.572 -0.74 . . . . 73.420000000000002 111.112 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.98 -30.92 71.97 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 123.159 0.584 . . . . 71.420000000000002 112.292 -177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -66.81 -28.39 68.33 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.424 0.69 . . . . 74.329999999999998 111.052 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.444 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 29.3 p -69.63 -37.9 76.98 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 119.285 -0.388 . . . . 60.030000000000001 110.922 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.453 ' H ' HD12 ' A' ' 68' ' ' ILE . 4.2 mp -67.86 -36.4 75.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 122.684 0.393 . . . . 75.450000000000003 110.371 176.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.412 ' HG3' ' HD3' ' A' ' 50' ' ' LYS . 85.4 mmm -56.36 -51.94 66.43 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.137 0.494 . . . . 73.140000000000001 110.856 173.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -63.3 -38.52 91.47 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.24 1.016 . . . . 50.420000000000002 111.798 177.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 67' ' ' THR . 4.6 tt -66.66 -59.16 3.84 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.67 1.188 . . . . 75.319999999999993 110.507 -175.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 48.7 t -64.67 -33.19 61.56 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 C-N-CA 124.128 0.971 . . . . 72.239999999999995 111.925 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.75 -38.73 82.57 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-O 120.772 0.32 . . . . 54.039999999999999 110.659 173.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.1 -30.29 63.55 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.445 0.698 . . . . 75.25 111.662 174.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 28.0 mtt -65.1 -39.53 93.27 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.095 0.558 . . . . 62.100000000000001 111.747 174.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -53.39 -24.0 11.19 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 123.805 0.842 . . . . 51.509999999999998 112.531 178.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -109.06 112.24 24.32 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 122.152 0.977 . . . . 52.310000000000002 109.819 169.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.3 t -64.3 -3.71 3.12 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.282 1.433 . . . . 61.020000000000003 113.705 -174.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.602 ' HG3' HG12 ' A' ' 80' ' ' ILE . 11.9 pt-20 -59.75 -25.22 64.68 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.98 0.912 . . . . 64.540000000000006 111.723 173.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.602 HG12 ' HG3' ' A' ' 79' ' ' GLU . 21.7 mm -91.35 -27.44 4.89 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.312 0 C-N-CA 125.2 1.4 . . . . 64.450000000000003 111.815 -177.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? 67.05 138.62 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 C-N-CA 124.936 1.294 . . . . 64.219999999999999 112.454 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.475 HG21 ' HE1' ' A' ' 39' ' ' TRP . 2.7 mp -94.56 89.65 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 CA-C-O 121.843 0.83 . . . . 61.43 109.2 -178.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 87' ' ' ILE . 96.9 m -67.2 131.01 44.92 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 114.702 -1.136 . . . . 71.129999999999995 111.276 -175.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 87' ' ' ILE . 49.4 m -62.76 -45.47 92.55 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.048 0.939 . . . . 33.030000000000001 113.333 -171.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' A' ' 88' ' ' ASP . 6.1 m-20 -72.63 -20.78 61.21 Favored 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 111.892 0.33 . . . . 64.230000000000004 111.892 174.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 40.1 tp -75.08 -33.22 61.64 Favored 'General case' 0 N--CA 1.478 0.952 0 O-C-N 121.966 -0.458 . . . . 72.329999999999998 111.284 173.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.476 HD13 HG12 ' A' ' 29' ' ' VAL . 62.5 mt -58.89 -35.8 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 109.303 -0.629 . . . . 74.239999999999995 109.303 169.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 85' ' ' ASP . 31.2 t70 -69.08 -32.01 71.16 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.272 1.029 . . . . 72.420000000000002 111.174 175.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.448 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 39.0 tttp -68.14 -40.23 82.49 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 116.127 -0.488 . . . . 72.030000000000001 109.953 177.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 60.0 t -55.53 -45.84 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.856 0.862 . . . . 65.329999999999998 110.458 172.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.48 ' HG2' HG21 ' A' ' 26' ' ' ILE . 29.3 mtpp -56.83 -52.02 66.72 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.544 0.737 . . . . 75.409999999999997 111.679 178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.11 -34.9 78.61 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.159 0.583 . . . . 65.510000000000005 112.335 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 89' ' ' LYS . 75.7 mmtt -64.47 -45.2 88.43 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.965 0.728 . . . . 65.25 112.965 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pp -79.99 -27.09 39.66 Favored 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 112.06 0.393 . . . . 72.340000000000003 112.06 177.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.6 -38.74 88.69 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.43 0.692 . . . . 73.420000000000002 110.703 166.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 38.5 ttm -63.51 -28.97 70.31 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.986 1.314 . . . . 70.450000000000003 112.132 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.453 HG12 HD21 ' A' ' 15' ' ' LEU . 66.2 t -65.76 -42.16 91.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.107 0 C-N-CA 123.517 0.727 . . . . 72.409999999999997 111.103 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 87.1 m -64.11 -41.25 97.32 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.113 0.565 . . . . 63.039999999999999 111.141 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 58.6 mtt180 -66.61 -38.14 86.35 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.735 0.814 . . . . 73.129999999999995 112.78 -177.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -79.56 -26.83 41.3 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 120.835 0.35 . . . . 74.319999999999993 111.229 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.411 ' O ' HG23 ' A' ' 105' ' ' VAL . 0.8 OUTLIER -66.35 -30.54 70.95 Favored 'General case' 0 CA--C 1.554 1.114 0 N-CA-C 109.626 -0.509 . . . . 74.019999999999996 109.626 173.119 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -57.34 -37.13 72.08 Favored 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 123.572 0.749 . . . . 63.310000000000002 111.258 171.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -71.71 -35.02 70.07 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.56 0.744 . . . . 50.329999999999998 111.27 174.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.75 -38.17 89.51 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.524 0.729 . . . . 75.329999999999998 110.153 176.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 101' ' ' LEU . 92.7 t -69.74 -55.58 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.588 0.755 . . . . 71.439999999999998 110.885 175.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m 60.21 94.8 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.577 1.151 . . . . 70.129999999999995 110.689 -170.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -74.32 75.91 1.14 Allowed Glycine 0 C--N 1.349 1.302 0 C-N-CA 122.967 0.317 . . . . 43.020000000000003 113.399 -175.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.0 t 65.6 1.39 1.72 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 125.648 1.579 . . . . 72.430000000000007 113.411 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -99.27 109.61 22.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.406 0.682 . . . . 74.340000000000003 110.873 -176.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 mp -110.51 -174.82 2.57 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.158 0.983 . . . . 71.010000000000005 109.92 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 29.4 m -120.8 153.36 56.98 Favored Pre-proline 0 N--CA 1.491 1.61 0 C-N-CA 123.572 0.749 . . . . 72.010000000000005 110.984 177.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_exo -67.28 103.38 0.77 Allowed 'Trans proline' 0 C--N 1.383 2.35 0 C-N-CA 122.517 2.145 . . . . 71.439999999999998 112.206 174.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 . . . . . 0 CA--C 1.572 1.791 0 C-N-CA 125.018 1.327 . . . . 54.340000000000003 112.031 -178.831 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.485 1.289 0 N-CA-C 110.012 -0.366 . . . . 73.319999999999993 110.012 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.54 -114.21 6.64 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 116.082 -0.508 . . . . 54.329999999999998 112.951 -177.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.6 t -167.6 137.61 2.79 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.639 0.776 . . . . 74.439999999999998 111.541 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -127.71 172.22 10.99 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.686 1.195 . . . . 73.129999999999995 109.788 170.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -56.13 -40.92 74.52 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 112.978 0.732 . . . . 73.310000000000002 112.978 -175.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.481 ' HA ' ' HD3' ' A' ' 9' ' ' LYS . 15.1 tp10 -68.7 -42.7 77.38 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.216 0.607 . . . . 74.019999999999996 111.112 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -57.16 -42.83 81.81 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.822 0.849 . . . . 74.329999999999998 110.72 172.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.78 -49.31 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 C-N-CA 124.301 1.04 . . . . 75.450000000000003 111.013 176.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 50.7 mtpt -53.05 -47.02 68.74 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.593 0.757 . . . . 73.420000000000002 111.557 176.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 10' ' ' LYS . 8.7 mtpm? -64.01 -55.47 22.08 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 115.338 -0.847 . . . . 75.340000000000003 111.641 -178.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 33.2 m -70.77 -25.09 25.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 112.612 0.597 . . . . 52.109999999999999 112.612 -173.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 92.5 m -74.0 -38.07 64.21 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.96 0.504 . . . . 73.230000000000004 111.036 174.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.78 -41.42 60.05 Favored 'General case' 0 CA--C 1.561 1.4 0 C-N-CA 123.036 0.535 . . . . 55.200000000000003 110.996 177.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -65.84 -26.02 67.47 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 124.491 1.117 . . . . 73.109999999999999 110.676 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.437 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.0 tt -59.1 -39.33 81.91 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.001 0.92 . . . . 53.240000000000002 111.564 170.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.56 -43.63 93.28 Favored 'General case' 0 N--CA 1.504 2.235 0 C-N-CA 122.581 0.352 . . . . 74.530000000000001 110.801 175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -61.76 -37.26 83.63 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.687 0.795 . . . . 75.200000000000003 111.246 176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.3 tp -73.28 -47.99 38.34 Favored 'General case' 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 64.310000000000002 110.498 -175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.441 ' HA ' HD11 ' A' ' 94' ' ' LEU . 58.8 mt -55.87 -44.44 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.52 1.128 . . . . 64.519999999999996 111.028 171.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -59.85 -44.31 94.18 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.714 0.806 . . . . 74.439999999999998 111.706 179.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.44 -41.84 84.09 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.266 0.626 . . . . 73.430000000000007 112.088 178.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.3 t -65.08 -51.2 69.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 122.735 0.414 . . . . 73.319999999999993 111.479 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.8 m-80 -58.55 -38.03 76.96 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.025 0.53 . . . . 74.510000000000005 111.7 177.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 27' ' ' LYS . 21.5 t70 -66.45 -43.82 84.52 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.303 0.641 . . . . 63.030000000000001 110.884 177.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.442 ' O ' HG23 ' A' ' 29' ' ' VAL . 0.6 OUTLIER -63.79 -37.43 87.33 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.01 0.924 . . . . 53.530000000000001 112.45 175.239 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 74.2 mt -64.31 -34.6 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.026 0.53 . . . . 73.010000000000005 110.936 177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 24' ' ' ASP . 84.8 mttt -61.81 -36.76 82.06 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.469 0.652 . . . . 75.319999999999993 110.827 172.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -75.61 -23.83 56.44 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.531 -0.759 . . . . 71.310000000000002 111.607 176.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.486 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 21.4 t -78.46 -24.19 13.48 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.561 0 O-C-N 121.809 -0.557 . . . . 73.120000000000005 111.152 169.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -67.79 -21.31 65.24 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.189 -0.945 . . . . 73.219999999999999 112.071 176.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -92.26 -28.31 17.07 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.602 0.361 . . . . 52.32 111.305 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 52.7 t-20 -138.3 93.79 11.26 Favored Pre-proline 0 N--CA 1.488 1.464 0 C-N-CA 123.375 0.67 . . . . 72.319999999999993 109.648 176.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.19 -14.75 31.76 Favored 'Trans proline' 0 C--N 1.378 2.09 0 C-N-CA 122.496 2.131 . . . . 53.439999999999998 113.228 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -96.01 2.48 53.43 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.093 0.957 . . . . 65.019999999999996 111.829 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.63 89.67 2.78 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-O 121.41 0.624 . . . . 74.010000000000005 110.417 -175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 31.3 mmt -66.58 -25.79 66.8 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.238 1.015 . . . . 74.200000000000003 112.514 -177.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.56 -45.3 72.47 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.462 0.705 . . . . 73.420000000000002 111.625 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -69.11 -31.11 69.6 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.059 0.544 . . . . 74.140000000000001 111.91 175.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.486 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 18.8 m95 -70.25 -35.33 73.74 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 111.881 0.326 . . . . 74.340000000000003 111.881 171.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -67.57 -35.19 78.55 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.621 0.768 . . . . 73.040000000000006 110.667 176.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.426 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 38.6 mtpt -60.19 -54.88 40.63 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.31 0.644 . . . . 71.209999999999994 110.744 172.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.7 mt -56.7 -41.23 74.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 124.073 0.949 . . . . 72.510000000000005 111.694 178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -59.54 -44.87 93.11 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.01 0.924 . . . . 60.229999999999997 111.652 177.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -70.54 -30.98 67.87 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.635 0.774 . . . . 63.140000000000001 112.375 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 86.1 mt -72.44 -42.41 65.05 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 122.661 0.385 . . . . 54.130000000000003 110.876 176.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.487 HG11 ' HB ' ' A' ' 68' ' ' ILE . 70.1 t -67.74 -28.83 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 123.961 0.905 . . . . 70.239999999999995 111.551 176.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -55.16 -42.86 73.66 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.827 0.851 . . . . 52.229999999999997 111.16 171.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.466 ' HB ' HD21 ' A' ' 18' ' ' LEU . 60.3 m -73.11 -42.9 62.44 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.239 0.616 . . . . 74.329999999999998 111.269 177.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 66.4 mtt -56.54 -42.1 77.92 Favored 'General case' 0 N--CA 1.497 1.916 0 C-N-CA 123.492 0.717 . . . . 74.510000000000005 111.947 178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -62.38 -47.92 82.03 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.181 -0.918 . . . . 73.150000000000006 110.229 178.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -55.04 -42.24 72.4 Favored 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.558 0.743 . . . . 72.310000000000002 112.281 177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 56' ' ' MET . 93.3 mt -57.48 -56.16 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 123.629 0.772 . . . . 53.240000000000002 111.304 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.451 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 3.3 t -67.92 -28.62 67.64 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.544 0.572 . . . . 64.239999999999995 112.544 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -66.96 -43.0 84.23 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 122.778 0.431 . . . . 53.43 111.958 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.5 t -72.32 -21.98 61.25 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 120.868 0.366 . . . . 74.549999999999997 111.038 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 52' ' ' ILE . 23.8 mmt -76.08 -19.21 58.78 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.256 0.623 . . . . 74.109999999999999 111.836 171.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.79 13.49 64.69 Favored Glycine 0 C--N 1.349 1.284 0 N-CA-C 114.09 0.396 . . . . 73.109999999999999 114.09 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.451 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 82.7 m-85 -89.43 91.46 8.73 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 117.445 0.622 . . . . 72.099999999999994 110.3 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.5 m -69.18 -35.81 76.67 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.656 0.782 . . . . 73.519999999999996 111.339 178.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.9 p -62.12 -46.21 90.06 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.35 1.06 . . . . 73.040000000000006 111.733 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.4 t -72.06 -41.97 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 CA-C-N 115.873 -0.603 . . . . 75.409999999999997 110.552 178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.76 65.41 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.162 0.585 . . . . 70.400000000000006 111.581 175.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 67' ' ' THR . 86.5 tttt -62.62 -46.6 87.52 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.384 0.674 . . . . 73.040000000000006 111.502 174.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -58.02 -44.45 87.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 123.018 0.527 . . . . 62.039999999999999 111.037 179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.63 -35.28 72.84 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.003 0.521 . . . . 53.420000000000002 111.083 177.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -67.6 -29.45 68.8 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.635 0.774 . . . . 70.129999999999995 111.05 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 63' ' ' LYS . 43.1 p -71.04 -27.36 63.6 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 110.607 -0.146 . . . . 71.120000000000005 110.607 177.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.487 ' HB ' HG11 ' A' ' 46' ' ' VAL . 12.6 mm -76.39 -34.33 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 N-CA-C 108.9 -0.778 . . . . 74.099999999999994 108.9 -177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.3 mtp -63.74 -46.93 83.11 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.865 -1.062 . . . . 73.239999999999995 110.482 176.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.71 -46.8 88.1 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.202 0.601 . . . . 74.049999999999997 111.213 175.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.71 -53.75 54.35 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.777 1.231 . . . . 71.439999999999998 110.973 -175.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 57.9 t -73.95 -34.38 39.26 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.155 0 C-N-CA 123.598 0.759 . . . . 73.230000000000004 112.29 -176.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -61.86 -34.97 76.96 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 120.934 0.397 . . . . 72.540000000000006 110.965 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG13 ' A' ' 80' ' ' ILE . 95.9 mttt -63.8 -33.48 75.78 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.402 0.681 . . . . 53.539999999999999 112.321 172.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 52.9 mtt -62.03 -38.14 87.56 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 122.607 0.363 . . . . 74.319999999999993 111.905 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -51.27 -36.83 44.06 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 124.358 1.063 . . . . 71.120000000000005 113.304 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.58 HD22 ' HB2' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -93.19 143.16 26.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.22 0.608 . . . . 73.299999999999997 111.692 -179.342 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 58.2 m -67.66 -3.25 8.51 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.51 1.124 . . . . 74.439999999999998 111.878 172.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.58 ' HB2' HD22 ' A' ' 77' ' ' ASN . 35.1 mm-40 -62.75 -29.9 71.03 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 124.542 1.137 . . . . 63.310000000000002 111.265 172.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.41 HG13 ' HB3' ' A' ' 74' ' ' LYS . 11.8 mm -127.73 145.14 35.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.212 0 C-N-CA 124.36 1.064 . . . . 71.129999999999995 110.644 -169.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -99.22 141.8 31.52 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.529 1.132 . . . . 61.219999999999999 111.46 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.7 mp -97.25 97.93 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 108.964 -0.754 . . . . 72.530000000000001 108.964 174.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 95.9 m -80.46 152.83 28.56 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.819 -0.628 . . . . 73.420000000000002 110.638 176.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 88.0 p -54.38 -53.24 56.69 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.749 0.82 . . . . 75.099999999999994 111.923 179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -72.7 -17.51 61.62 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.616 0.767 . . . . 61.340000000000003 112.802 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.59 -34.19 76.53 Favored 'General case' 0 CA--C 1.555 1.149 0 CA-C-O 120.832 0.349 . . . . 75.120000000000005 110.728 172.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 56.2 mt -63.71 -35.52 73.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.263 0 C-N-CA 123.012 0.525 . . . . 74.25 110.133 172.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.56 -29.48 68.05 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.66 0.784 . . . . 65.040000000000006 110.867 173.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -69.01 -30.73 69.18 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.146 0.578 . . . . 72.439999999999998 110.33 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.448 HG13 HG23 ' A' ' 68' ' ' ILE . 39.8 t -73.58 -50.29 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.882 0.873 . . . . 72.239999999999995 110.503 171.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -59.7 -50.41 73.94 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 113.942 -1.481 . . . . 73.549999999999997 111.717 -170.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -69.58 -31.96 70.42 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.231 0.612 . . . . 54.32 112.231 -175.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -66.35 -31.91 72.98 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 123.227 0.611 . . . . 74.239999999999995 111.993 171.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 19' ' ' ILE . 1.5 tm? -75.56 -34.32 60.7 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.336 0.655 . . . . 53.399999999999999 109.61 177.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -63.56 -35.32 80.1 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.721 0.808 . . . . 55.109999999999999 111.03 168.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . 0.463 ' HA ' ' HB3' ' A' ' 99' ' ' ARG . 29.2 ttm -65.21 -26.72 68.25 Favored 'General case' 0 CA--C 1.558 1.273 0 C-N-CA 124.151 0.98 . . . . 62.039999999999999 111.959 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.6 t -66.22 -43.37 91.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-O 121.177 0.513 . . . . 70.150000000000006 110.63 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 91.5 m -63.83 -39.45 94.25 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.783 0.833 . . . . 62.030000000000001 111.061 172.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 96' ' ' MET . 77.4 ttt180 -69.23 -27.78 65.77 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 125.518 1.527 . . . . 71.439999999999998 111.57 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -73.04 -54.87 7.46 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.263 1.025 . . . . 74.0 109.775 175.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 104' ' ' LYS . 40.3 tp -61.06 -27.84 68.64 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.615 0.766 . . . . 73.040000000000006 111.582 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.59 -40.43 65.66 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.47 1.108 . . . . 64.140000000000001 111.616 173.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -76.78 -38.66 53.63 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.53 0.732 . . . . 71.319999999999993 111.311 175.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.469 ' HB3' HD12 ' A' ' 101' ' ' LEU . 35.6 ttmt -65.35 -38.39 89.95 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.082 0.953 . . . . 55.340000000000003 113.057 -175.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.3 m -70.86 -15.52 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.281 0.633 . . . . 65.010000000000005 112.443 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 39.3 t -74.91 -27.07 60.07 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.994 0.517 . . . . 74.120000000000005 110.859 172.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.88 58.94 6.34 Favored Glycine 0 C--N 1.353 1.481 0 CA-C-N 116.152 -0.476 . . . . 75.329999999999998 113.704 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.3 m -68.0 92.22 0.37 Allowed 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.255 0.622 . . . . 75.129999999999995 110.686 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 60.02 91.76 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.055 1.342 . . . . 72.430000000000007 111.982 -178.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 110' ' ' LEU . 1.9 pt? -62.5 105.4 0.62 Allowed 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 121.744 0.783 . . . . 61.140000000000001 111.296 178.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 35.4 m -73.2 142.02 81.65 Favored Pre-proline 0 CA--C 1.56 1.351 0 CA-C-N 115.791 -0.64 . . . . 71.219999999999999 111.976 -177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.57 -28.96 25.55 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.211 1.94 . . . . 72.409999999999997 112.431 172.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.3 ptp180 . . . . . 0 CA--C 1.571 1.767 0 C-N-CA 124.225 1.01 . . . . 71.129999999999995 110.482 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.1 mtt . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.439 0.162 . . . . 74.5 111.138 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.26 75.85 1.72 Allowed Glycine 0 C--N 1.352 1.42 0 CA-C-N 116.297 -0.41 . . . . 74.0 112.736 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -74.97 -44.56 47.66 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.917 0.887 . . . . 75.219999999999999 111.353 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.7 m-70 -129.81 146.85 51.54 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.03 0.932 . . . . 75.019999999999996 111.153 -176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -63.08 -25.27 68.29 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.028 0.931 . . . . 42.350000000000001 111.834 171.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 1.9 mp0 -52.09 -38.46 57.33 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.372 1.069 . . . . 72.099999999999994 112.649 176.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.15 -44.16 97.22 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 122.7 0.4 . . . . 74.439999999999998 111.247 173.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.4 mt -60.17 -38.58 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.704 0.802 . . . . 74.129999999999995 111.037 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -64.51 -43.3 94.53 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.655 0.782 . . . . 73.310000000000002 111.611 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 1.6 mptm? -66.06 -51.45 58.01 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.34 0.656 . . . . 60.310000000000002 111.706 179.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.3 p -65.17 -21.06 28.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.291 0.636 . . . . 72.409999999999997 111.739 -177.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.445 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 42.1 m -59.77 -53.27 59.92 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.152 0.581 . . . . 53.420000000000002 111.089 169.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -76.58 -28.74 56.31 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.103 0.561 . . . . 73.140000000000001 112.238 -178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.01 -33.54 76.04 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 122.951 0.5 . . . . 74.230000000000004 110.586 170.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -65.24 -37.88 88.61 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.501 0.721 . . . . 61.130000000000003 110.754 167.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 12' ' ' THR . 72.2 mmtt -68.11 -34.08 75.71 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.565 0.346 . . . . 73.200000000000003 111.724 177.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -65.18 -34.88 79.42 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 122.007 0.908 . . . . 75.400000000000006 111.26 172.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD21 ' HB ' ' A' ' 48' ' ' THR . 8.2 tp -69.79 -47.74 61.77 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 114.089 -1.414 . . . . 74.510000000000005 110.432 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.02 -33.49 62.58 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 124.854 1.262 . . . . 72.400000000000006 110.995 174.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -59.26 -50.48 73.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.657 0.783 . . . . 65.299999999999997 111.434 177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -64.42 -53.72 44.04 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.033 -0.53 . . . . 61.32 111.282 176.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.458 HG13 HG23 ' A' ' 42' ' ' ILE . 92.6 t -57.23 -39.0 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 N-CA-C 112.39 0.515 . . . . 71.400000000000006 112.39 -176.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -60.12 -51.68 68.57 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 118.211 0.46 . . . . 74.420000000000002 111.538 175.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 21.8 t70 -68.8 -33.48 73.93 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 122.714 0.406 . . . . 74.420000000000002 111.455 -175.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.515 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.1 m-20 -63.86 -47.47 80.57 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 124.016 0.926 . . . . 73.430000000000007 110.92 172.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.622 HG21 ' HG2' ' A' ' 91' ' ' LYS . 86.3 mt -63.66 -36.26 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 123.013 0.525 . . . . 43.399999999999999 111.621 177.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 49.8 mtpt -57.3 -43.86 83.6 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.373 0.606 . . . . 65.340000000000003 111.021 174.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -71.81 -26.54 62.44 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.333 -0.848 . . . . 73.439999999999998 112.001 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.557 HG12 HD13 ' A' ' 87' ' ' ILE . 89.0 t -74.27 -33.39 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 123.119 0.568 . . . . 74.450000000000003 111.7 173.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.93 -22.44 65.61 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.105 0.562 . . . . 65.230000000000004 110.605 174.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -91.28 -44.81 8.97 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.438 1.095 . . . . 65.200000000000003 110.609 171.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -124.8 82.86 59.93 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 124.263 1.025 . . . . 54.329999999999998 110.827 -172.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -69.98 -40.97 4.39 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.44 2.093 . . . . 73.510000000000005 114.522 -168.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.535 ' HA ' HD13 ' A' ' 82' ' ' ILE . 4.7 tm-20 -75.28 -16.37 60.44 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.752 0.821 . . . . 64.25 111.617 -170.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -64.9 96.16 0.18 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.039 0.935 . . . . 74.519999999999996 112.438 -175.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.457 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 12.0 mmt -79.85 -2.79 45.09 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.991 0.917 . . . . 62.409999999999997 113.341 -178.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -70.79 -36.47 73.02 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.672 0.789 . . . . 62.329999999999998 110.575 167.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -73.04 -47.62 43.22 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 73.439999999999998 111.387 171.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 86.6 m95 -64.96 -27.53 68.9 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 112.688 0.625 . . . . 75.319999999999993 112.688 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -54.89 -50.72 68.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.757 0.823 . . . . 74.340000000000003 110.754 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 73.6 mmtt -59.7 -57.07 14.52 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.351 -0.84 . . . . 64.329999999999998 110.185 177.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.458 HG23 HG13 ' A' ' 22' ' ' VAL . 85.6 mt -54.41 -41.22 52.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.465 1.106 . . . . 74.239999999999995 112.203 -175.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.419 ' HB2' HG11 ' A' ' 72' ' ' VAL . 1.1 t80 -65.89 -53.52 38.51 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.293 0.637 . . . . 60.109999999999999 111.139 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -69.28 -27.99 65.91 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.167 0.587 . . . . 75.120000000000005 112.561 -175.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 82.6 mt -78.41 -39.13 39.78 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.961 0.504 . . . . 53.539999999999999 110.94 177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.57 HG11 ' HB ' ' A' ' 68' ' ' ILE . 25.1 t -67.64 -29.9 46.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 C-N-CA 123.227 0.611 . . . . 72.010000000000005 111.391 172.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -59.78 -38.52 82.09 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.65 0.78 . . . . 72.040000000000006 110.5 171.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.561 ' HB ' HD21 ' A' ' 18' ' ' LEU . 30.7 m -74.71 -34.67 62.64 Favored 'General case' 0 CA--C 1.557 1.221 0 CA-C-N 115.19 -0.914 . . . . 75.129999999999995 111.274 174.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.5 mtt -64.73 -33.53 76.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.422 -0.799 . . . . 70.25 110.932 174.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -63.78 -52.99 57.83 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.906 0.882 . . . . 65.409999999999997 110.615 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 48' ' ' THR . 11.4 pt-20 -58.72 -36.34 74.13 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.268 0.227 . . . . 70.530000000000001 111.51 179.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.8 mt -66.22 -50.75 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 123.718 0.807 . . . . 61.109999999999999 111.976 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.444 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.8 t -66.33 -29.69 69.94 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 122.014 -0.429 . . . . 73.400000000000006 111.91 178.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -72.42 -36.2 68.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 122.88 0.472 . . . . 54.32 111.483 175.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 51.0 p -74.04 -22.7 59.45 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 122.845 0.458 . . . . 63.200000000000003 111.51 174.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 61.4 mtt -85.25 -7.72 58.88 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.286 0.634 . . . . 34.140000000000001 111.81 171.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.46 18.77 78.86 Favored Glycine 0 CA--C 1.535 1.286 0 N-CA-C 114.646 0.618 . . . . 70.200000000000003 114.646 175.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.444 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 46.6 m-85 -86.88 102.42 14.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.829 0.852 . . . . 71.109999999999999 110.637 175.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.4 m -76.64 -45.49 29.69 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.939 0.495 . . . . 62.420000000000002 111.699 -179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 70.4 m -60.74 -38.86 86.57 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.267 0.627 . . . . 61.149999999999999 111.845 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.4 t -73.52 -44.48 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 115.703 -0.681 . . . . 32.130000000000003 110.283 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.03 -33.62 57.76 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.92 0.488 . . . . 72.129999999999995 111.863 174.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.438 ' O ' HG23 ' A' ' 67' ' ' THR . 59.4 tttm -66.01 -43.35 87.95 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.805 0.842 . . . . 62.149999999999999 111.417 175.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 85.9 t -61.73 -45.15 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 C-N-CA 123.449 0.7 . . . . 70.319999999999993 111.485 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.557 HD12 HG13 ' A' ' 46' ' ' VAL . 3.8 mm? -66.89 -35.25 79.6 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.653 0.381 . . . . 74.319999999999993 110.929 174.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -65.47 -28.41 69.2 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.868 0.867 . . . . 64.519999999999996 111.287 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' O ' ' A' ' 63' ' ' LYS . 24.3 p -71.61 -37.92 70.88 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 110.161 -0.311 . . . . 61.240000000000002 110.161 175.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.57 ' HB ' HG11 ' A' ' 46' ' ' VAL . 14.7 mm -69.18 -40.23 80.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 123.112 0.565 . . . . 74.129999999999995 110.51 -179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 81.8 mmm -51.44 -50.7 59.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.19 0.996 . . . . 54.100000000000001 110.866 172.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -65.68 -39.81 91.69 Favored 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 114.66 -1.154 . . . . 62.240000000000002 112.036 178.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.423 HD21 ' HG ' ' A' ' 86' ' ' LEU . 6.2 tt -67.17 -55.72 12.93 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.642 1.177 . . . . 44.149999999999999 111.073 -172.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' A' ' 43' ' ' TYR . 41.0 t -64.98 -38.43 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.622 0.769 . . . . 74.120000000000005 111.082 -178.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -55.17 -43.13 74.01 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.602 1.161 . . . . 74.430000000000007 111.763 176.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.41 -33.03 58.83 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 115.62 -0.718 . . . . 71.010000000000005 112.748 -176.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.549 ' HB3' HG13 ' A' ' 82' ' ' ILE . 53.7 mtm -74.13 -29.26 61.73 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 112.018 0.377 . . . . 64.129999999999995 112.018 177.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 44.0 tp -49.42 -39.35 32.46 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 125.015 1.326 . . . . 70.439999999999998 113.029 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.86 138.15 37.11 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.443 0.697 . . . . 73.420000000000002 111.15 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.1 t -75.92 74.0 2.83 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.776 0.798 . . . . 75.439999999999998 110.533 178.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' HG3' HG13 ' A' ' 80' ' ' ILE . 10.4 pt-20 -159.61 -35.79 0.06 Allowed 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 114.573 -1.194 . . . . 73.040000000000006 109.737 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.547 HG13 ' HG3' ' A' ' 79' ' ' GLU . 72.9 mt -106.0 107.31 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 124.155 0.982 . . . . 52.109999999999999 108.711 173.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -64.67 148.6 50.66 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.161 0.505 . . . . 73.030000000000001 112.165 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.549 HG13 ' HB3' ' A' ' 75' ' ' MET . 3.5 mp -84.62 86.17 2.22 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.739 -0.837 . . . . 71.329999999999998 108.739 178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 92.4 m -67.95 131.43 45.46 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.27 -1.332 . . . . 75.409999999999997 110.582 -179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.515 ' HA ' HD12 ' A' ' 87' ' ' ILE . 44.6 t -61.04 -36.11 78.7 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.05 0.54 . . . . 51.140000000000001 112.241 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.23 -34.07 77.48 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.29 0.636 . . . . 71.439999999999998 111.316 174.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.54 HD23 ' SD ' ' A' ' 75' ' ' MET . 20.6 tp -75.84 -35.35 59.99 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.259 0.624 . . . . 74.329999999999998 111.956 178.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.557 HD13 HG12 ' A' ' 29' ' ' VAL . 59.3 mt -57.81 -34.41 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.193 0.597 . . . . 72.530000000000001 109.986 167.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -70.4 -29.19 65.75 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.782 -0.644 . . . . 64.109999999999999 110.346 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -65.72 -39.57 91.3 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.119 0.568 . . . . 75.540000000000006 110.379 174.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.0 t -67.06 -42.21 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.4 0.68 . . . . 70.510000000000005 110.797 174.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.622 ' HG2' HG21 ' A' ' 26' ' ' ILE . 5.7 tmtp? -63.08 -51.48 66.48 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.741 1.216 . . . . 73.439999999999998 111.096 -174.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.82 -34.97 67.2 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.569 -0.741 . . . . 72.430000000000007 112.321 -175.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.511 ' O ' HG23 ' A' ' 97' ' ' VAL . 68.4 mttm -68.74 -30.61 69.27 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 111.797 0.295 . . . . 52.439999999999998 111.797 173.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.44 HD22 HG12 ' A' ' 22' ' ' VAL . 61.2 tp -68.24 -40.22 82.06 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.397 0.679 . . . . 74.450000000000003 110.836 172.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.406 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 35.9 m-20 -56.76 -40.8 76.46 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.981 0.913 . . . . 75.340000000000003 111.73 170.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -63.25 -42.1 99.14 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 114.942 -1.027 . . . . 70.140000000000001 111.516 175.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 93' ' ' LYS . 57.3 t -58.71 -43.85 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.393 0.677 . . . . 74.099999999999994 111.178 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 59.9 m -59.61 -59.21 5.81 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.481 -0.781 . . . . 61.329999999999998 111.18 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.406 ' NH2' ' HB3' ' A' ' 95' ' ' ASP . 49.4 mtm-85 -67.6 -24.14 65.45 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.945 0.898 . . . . 73.329999999999998 112.835 -175.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.529 ' HA ' ' HE3' ' A' ' 103' ' ' LYS . 26.4 tp10 -64.28 -38.51 91.28 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.144 0.578 . . . . 60.340000000000003 111.352 175.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -35.91 65.82 Favored 'General case' 0 CA--C 1.561 1.383 0 CA-C-N 116.345 -0.389 . . . . 53.539999999999999 110.569 175.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.03 -41.69 97.33 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 111.979 0.362 . . . . 63.340000000000003 111.979 177.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.529 ' HE3' ' HA ' ' A' ' 100' ' ' GLU . 17.3 ptpt -70.61 -26.41 63.48 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 122.634 0.374 . . . . 75.239999999999995 110.911 178.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -66.14 -47.19 74.88 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.074 0.949 . . . . 74.150000000000006 111.407 175.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.58 -46.52 82.85 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 C-N-CA 123.388 0.675 . . . . 75.209999999999994 110.921 177.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 35.7 t -159.0 126.6 4.93 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.574 0.749 . . . . 63.020000000000003 110.167 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.93 -81.02 0.73 Allowed Glycine 0 CA--C 1.54 1.606 0 N-CA-C 113.91 0.324 . . . . 52.240000000000002 113.91 -175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 63.4 m -146.08 177.38 9.01 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.293 0.637 . . . . 62.119999999999997 112.48 -173.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -165.05 -50.48 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.182 0.993 . . . . 75.310000000000002 111.06 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.91 90.07 0.12 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.55 0.74 . . . . 71.430000000000007 112.621 -172.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 27.8 m -105.4 139.01 19.74 Favored Pre-proline 0 N--CA 1.483 1.188 0 C-N-CA 124.25 1.02 . . . . 75.099999999999994 110.585 177.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.83 -36.65 30.7 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.594 2.196 . . . . 62.140000000000001 112.579 172.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 50.4 mtt180 . . . . . 0 N--CA 1.488 1.44 0 C-N-CA 124.024 0.93 . . . . 60.329999999999998 111.021 -178.745 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.3 mtm . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.717 0.294 . . . . 64.299999999999997 110.493 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.17 147.31 9.07 Favored Glycine 0 CA--C 1.538 1.531 0 N-CA-C 114.622 0.609 . . . . 62.119999999999997 114.622 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 82.3 p -71.85 135.25 46.54 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.099 0.56 . . . . 50.25 110.539 176.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -74.33 163.05 28.26 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.312 0.856 . . . . 73.530000000000001 113.312 -171.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -66.16 -39.02 89.47 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.083 -0.962 . . . . 53.039999999999999 111.551 -175.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -65.48 -32.59 74.27 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.082 0.553 . . . . 72.310000000000002 112.24 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 11' ' ' VAL . 45.6 t80 -60.48 -45.55 93.35 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.919 0.488 . . . . 72.129999999999995 110.787 171.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 74.3 mt -63.7 -40.3 88.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 124.165 0.986 . . . . 75.219999999999999 111.54 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -61.24 -39.09 89.01 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.673 0.789 . . . . 41.020000000000003 111.139 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 99.3 mttt -68.92 -47.52 65.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.249 0.62 . . . . 74.329999999999998 111.839 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 86.6 t -56.39 -36.37 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 C-N-CA 123.745 0.818 . . . . 62.350000000000001 111.679 176.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 48.3 m -66.63 -33.03 74.76 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.082 0.553 . . . . 74.299999999999997 111.178 174.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.674 ' HA ' ' HG2' ' A' ' 16' ' ' LYS . 81.0 m-20 -76.5 -30.96 57.43 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.895 0.702 . . . . 53.32 112.895 173.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 7.2 mm-40 -67.19 -28.06 67.78 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.357 0.598 . . . . 72.310000000000002 110.196 174.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.467 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.5 tp -59.32 -44.78 92.55 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.046 -0.979 . . . . 65.209999999999994 111.585 168.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.674 ' HG2' ' HA ' ' A' ' 13' ' ' ASP . 25.9 mmtm -63.1 -44.09 96.65 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 120.945 0.402 . . . . 73.340000000000003 110.938 -175.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -55.79 -40.74 73.11 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 115.163 -0.926 . . . . 55.450000000000003 111.168 173.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.487 HD21 ' HB ' ' A' ' 48' ' ' THR . 7.8 tp -68.32 -44.22 75.85 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 114.837 -1.074 . . . . 73.129999999999995 111.313 -176.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 73.1 mt -59.68 -44.84 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.831 0.852 . . . . 64.400000000000006 110.118 174.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -59.31 -45.49 91.14 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.194 0.997 . . . . 70.129999999999995 111.92 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -64.06 -53.21 53.41 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.69 0.396 . . . . 75.450000000000003 111.647 177.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.465 HG13 HG23 ' A' ' 42' ' ' ILE . 53.2 t -55.96 -48.92 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 C-N-CA 123.433 0.693 . . . . 71.319999999999993 112.059 -178.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -53.22 -47.68 68.76 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.279 0.632 . . . . 71.340000000000003 111.935 175.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.12 -38.63 91.76 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.601 0.761 . . . . 74.450000000000003 111.391 179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -65.48 -43.55 89.86 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.695 0.798 . . . . 64.129999999999995 111.823 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 22' ' ' VAL . 72.2 mt -65.19 -34.78 72.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.322 0 C-N-CA 123.352 0.661 . . . . 64.129999999999995 110.999 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -61.52 -37.05 82.32 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.347 0.659 . . . . 52.240000000000002 111.684 173.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -72.51 -24.13 61.11 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.85 -0.614 . . . . 63.109999999999999 111.764 174.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.496 HG12 HD13 ' A' ' 87' ' ' ILE . 45.6 t -75.23 -30.11 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.531 0 O-C-N 122.265 -0.272 . . . . 74.310000000000002 111.244 169.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -29.79 67.88 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.161 -0.962 . . . . 64.430000000000007 112.051 177.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -90.54 -27.65 19.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 123.155 0.582 . . . . 63.229999999999997 111.618 174.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -129.01 72.68 82.0 Favored Pre-proline 0 N--CA 1.499 1.994 0 C-N-CA 124.263 1.025 . . . . 65.230000000000004 110.557 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -59.67 -51.03 6.71 Favored 'Trans proline' 0 C--N 1.385 2.494 0 C-N-CA 123.525 2.817 . . . . 71.239999999999995 115.763 -168.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -84.19 10.13 11.08 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.245 0.618 . . . . 53.219999999999999 112.653 -172.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.08 96.27 1.74 Allowed 'General case' 0 CA--C 1.558 1.254 0 O-C-N 121.67 -0.644 . . . . 73.140000000000001 109.979 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.435 ' HE3' HD11 ' A' ' 82' ' ' ILE . 28.2 mmt -71.24 -31.3 67.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.098 0.959 . . . . 62.140000000000001 112.755 -173.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -69.42 -31.94 70.6 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.265 0.626 . . . . 54.439999999999998 111.142 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -74.8 -38.49 62.08 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.499 0.319 . . . . 73.329999999999998 111.397 175.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.474 ' CE2' HG11 ' A' ' 29' ' ' VAL . 39.6 m95 -64.81 -30.81 71.83 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.93 0.492 . . . . 75.439999999999998 111.59 171.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -59.82 -42.93 94.61 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.587 1.155 . . . . 74.230000000000004 110.932 172.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.3 mmtp -57.76 -54.25 49.06 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.578 0.751 . . . . 73.420000000000002 111.654 174.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.465 HG23 HG13 ' A' ' 22' ' ' VAL . 69.8 mt -58.6 -39.17 74.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 124.145 0.978 . . . . 74.150000000000006 111.614 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.04 -44.64 97.1 Favored 'General case' 0 CA--C 1.562 1.424 0 C-N-CA 124.43 1.092 . . . . 75.150000000000006 110.769 -179.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 78.9 mtt180 -64.29 -30.21 71.27 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.818 0.847 . . . . 70.230000000000004 112.381 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.3 mt -76.8 -42.43 40.65 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.335 0.654 . . . . 73.239999999999995 111.209 178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 68.0 t -67.09 -31.18 52.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.273 0.629 . . . . 73.150000000000006 110.827 175.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.4 m80 -52.05 -45.72 64.8 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.441 0.696 . . . . 73.109999999999999 111.14 168.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.487 ' HB ' HD21 ' A' ' 18' ' ' LEU . 52.7 m -73.81 -37.19 64.97 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.729 -0.669 . . . . 74.120000000000005 111.746 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.422 ' HB2' HD13 ' A' ' 65' ' ' LEU . 43.7 mtt -62.64 -52.34 63.72 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.98 0.419 . . . . 71.140000000000001 110.886 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -49.41 -44.09 45.04 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.841 1.256 . . . . 73.340000000000003 111.888 172.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -62.94 -42.92 99.96 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.302 0.641 . . . . 54.119999999999997 112.036 175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 87.4 mt -61.25 -48.3 89.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 C-N-CA 123.643 0.777 . . . . 73.409999999999997 111.347 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.529 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 6.8 t -69.53 -35.58 75.6 Favored 'General case' 0 CA--C 1.555 1.145 0 N-CA-C 112.512 0.56 . . . . 52.539999999999999 112.512 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -70.41 -34.92 73.08 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 112.56 0.578 . . . . 63.32 112.56 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.1 t -73.8 -21.67 60.07 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-O 120.757 0.313 . . . . 73.439999999999998 111.375 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.6 mtt -85.76 -12.38 51.16 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.663 0.785 . . . . 63.119999999999997 111.908 170.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.16 21.56 51.82 Favored Glycine 0 N--CA 1.479 1.552 0 N-CA-C 114.951 0.74 . . . . 64.150000000000006 114.951 174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.529 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 88.0 m-85 -97.05 88.86 4.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.664 0.786 . . . . 65.430000000000007 110.595 177.112 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 49.7 m -71.4 -24.95 62.15 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.039 0.535 . . . . 63.140000000000001 111.624 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 49.9 m -68.12 -44.18 76.71 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.839 0.856 . . . . 72.430000000000007 111.672 176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.437 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 38.2 t -70.53 -39.41 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 C-N-CA 122.753 0.421 . . . . 75.430000000000007 110.216 176.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.9 -33.3 71.67 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.163 0.585 . . . . 64.420000000000002 111.811 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.56 -41.99 83.32 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.951 0.9 . . . . 74.340000000000003 111.469 176.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.7 -43.29 87.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.813 0.445 . . . . 62.340000000000003 110.231 174.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' MET . 66.7 mt -74.23 -29.07 61.54 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 116.0 -0.545 . . . . 73.409999999999997 111.905 178.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -66.16 -28.49 68.82 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.814 0.846 . . . . 72.219999999999999 110.95 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.6 p -71.37 -35.98 71.3 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.794 -0.447 . . . . 74.310000000000002 109.794 175.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 9.1 mm -69.81 -41.94 79.89 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 123.707 0.803 . . . . 63.5 110.421 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LEU . 60.3 mmm -55.87 -48.46 75.52 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.164 0.986 . . . . 61.25 110.376 175.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -68.19 -37.58 81.09 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.777 0.831 . . . . 73.510000000000005 111.865 178.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.7 tt -61.61 -51.48 68.32 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.421 1.088 . . . . 72.439999999999998 110.302 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 39' ' ' TRP . 47.5 t -69.06 -41.64 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 CA-C-N 115.026 -0.988 . . . . 71.439999999999998 111.338 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -56.67 -38.07 71.71 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.978 0.911 . . . . 53.140000000000001 111.49 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -68.16 -32.37 72.59 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.219 1.008 . . . . 63.420000000000002 111.491 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 54.2 mtt -67.33 -35.84 80.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.145 0.578 . . . . 73.439999999999998 112.472 177.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -51.49 -27.53 10.86 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.072 1.508 . . . . 63.450000000000003 115.072 -174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.8 p30 -85.22 171.2 12.14 Favored 'General case' 0 N--CA 1.497 1.917 0 CA-C-N 118.709 0.686 . . . . 73.040000000000006 112.356 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -79.89 -20.6 45.46 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.744 0.818 . . . . 74.310000000000002 112.189 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -87.06 -10.81 52.07 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 112.925 0.713 . . . . 75.150000000000006 112.925 -168.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 mm -118.07 126.73 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 C-N-CA 123.983 0.913 . . . . 62.420000000000002 110.544 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -96.89 153.26 18.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.247 0.619 . . . . 65.219999999999999 111.188 177.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.435 HD11 ' HE3' ' A' ' 36' ' ' MET . 2.8 mp -96.55 111.27 26.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 124.141 0.976 . . . . 72.0 110.135 -170.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 87' ' ' ILE . 64.3 m -77.98 130.1 36.1 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.473 0.709 . . . . 74.439999999999998 110.855 -179.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 80.3 p -61.88 -43.98 97.73 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.792 0.837 . . . . 63.549999999999997 113.204 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -75.78 -20.96 57.86 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.796 0.438 . . . . 72.109999999999999 111.776 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.407 ' O ' HG23 ' A' ' 90' ' ' VAL . 25.3 tp -73.43 -34.74 65.59 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.686 0.394 . . . . 71.420000000000002 110.965 172.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.496 HD13 HG12 ' A' ' 29' ' ' VAL . 69.3 mt -56.67 -42.16 76.06 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 109.352 -0.611 . . . . 74.129999999999995 109.352 170.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -66.1 -30.91 71.5 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 115.495 -0.775 . . . . 64.439999999999998 110.681 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 36.6 ttmt -68.27 -37.36 80.65 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.517 0.727 . . . . 73.049999999999997 111.047 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 86' ' ' LEU . 17.4 t -62.03 -38.74 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.119 0.568 . . . . 61.539999999999999 110.438 177.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -59.67 -43.92 93.79 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 122.817 0.447 . . . . 72.200000000000003 111.725 171.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -63.2 -31.48 72.64 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.232 0.613 . . . . 72.010000000000005 112.027 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 97' ' ' VAL . 75.2 mmtt -63.86 -39.2 93.64 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.433 0.693 . . . . 71.420000000000002 111.42 172.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -75.36 -28.56 59.6 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.306 0.642 . . . . 74.349999999999994 112.011 176.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.44 -40.49 86.97 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.026 0.53 . . . . 52.439999999999998 110.033 166.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.0 ttt -70.61 -32.32 69.62 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.509 1.124 . . . . 74.109999999999999 112.016 177.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 93' ' ' LYS . 61.5 t -63.24 -43.16 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 121.028 0.442 . . . . 74.109999999999999 110.275 174.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 56.6 m -70.11 -45.55 66.67 Favored 'General case' 0 CA--C 1.563 1.447 0 CA-C-N 115.471 -0.786 . . . . 73.150000000000006 111.375 177.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 102' ' ' ASP . 2.8 mmt180 -72.3 -31.58 65.83 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.533 0.938 . . . . 75.219999999999999 113.533 -176.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.4 -34.19 58.83 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.511 0.672 . . . . 73.420000000000002 110.185 176.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.658 HD21 ' HE3' ' A' ' 16' ' ' LYS . 46.1 tp -62.89 -31.37 72.4 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.2 1.0 . . . . 71.540000000000006 111.495 171.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.426 ' HB3' ' O ' ' A' ' 99' ' ' ARG . 20.9 t70 -57.3 -37.84 73.06 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.831 0.852 . . . . 65.319999999999993 111.892 175.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.4 -36.23 68.67 Favored 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 123.719 0.807 . . . . 71.409999999999997 111.945 178.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.522 ' HD3' HD12 ' A' ' 101' ' ' LEU . 50.3 mtpt -60.39 -47.0 87.97 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.817 0.847 . . . . 73.340000000000003 112.498 179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.08 -18.05 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 123.165 0.586 . . . . 74.420000000000002 111.53 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.4 t -76.18 -33.38 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.667 0.787 . . . . 75.349999999999994 111.339 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.53 -36.65 4.26 Favored Glycine 0 C--N 1.35 1.309 0 CA-C-N 116.047 -0.524 . . . . 61.32 113.215 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 19.4 t -159.87 176.76 11.53 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.526 0.73 . . . . 71.530000000000001 110.87 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -85.43 103.14 14.05 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.56 0.744 . . . . 75.319999999999993 111.364 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.7 -39.89 30.23 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 109.317 -0.623 . . . . 71.129999999999995 109.317 169.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.3 m -116.97 143.41 31.54 Favored Pre-proline 0 CA--C 1.562 1.412 0 N-CA-C 108.688 -0.856 . . . . 65.439999999999998 108.688 159.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.87 -51.21 0.68 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.378 2.052 . . . . 70.049999999999997 113.295 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 5.1 ttp180 . . . . . 0 CA--C 1.567 1.624 0 C-N-CA 123.71 0.804 . . . . 75.120000000000005 110.729 -169.227 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.558 0.694 . . . . 65.400000000000006 110.977 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.08 54.01 4.51 Favored Glycine 0 CA--C 1.534 1.241 0 O-C-N 121.968 -0.458 . . . . 71.340000000000003 112.068 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.3 m 52.82 -84.19 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.974 1.31 . . . . 63.340000000000003 112.163 -174.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -148.09 -59.67 0.25 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.312 1.045 . . . . 73.299999999999997 110.037 175.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -72.32 -44.95 61.95 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.834 0.854 . . . . 75.120000000000005 112.107 -177.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -63.71 -30.54 71.63 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.725 0.41 . . . . 63.420000000000002 110.935 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -56.8 -55.37 35.21 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.882 0.873 . . . . 75.239999999999995 110.39 171.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.4 mm -59.01 -37.31 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.967 0.907 . . . . 74.109999999999999 112.014 178.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -66.32 -36.46 82.98 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.422 0.689 . . . . 71.439999999999998 112.044 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -70.65 -39.86 73.39 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.067 0.547 . . . . 73.310000000000002 111.048 171.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.83 -23.72 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 124.104 0.962 . . . . 72.329999999999998 111.5 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 56.2 m -68.57 -39.49 80.97 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.738 0.415 . . . . 73.099999999999994 110.657 172.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -71.48 -31.57 67.27 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.63 0.372 . . . . 72.400000000000006 111.16 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 11.5 mm-40 -64.0 -33.68 76.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.085 0.554 . . . . 62.450000000000003 110.53 173.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.6 tt -64.59 -45.29 87.59 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 124.293 1.037 . . . . 51.229999999999997 111.271 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -58.97 -45.83 89.6 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 123.405 0.682 . . . . 74.519999999999996 111.308 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.11 -45.34 95.07 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.845 0.858 . . . . 71.140000000000001 111.243 176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 14' ' ' GLU . 2.7 tp -59.87 -50.79 72.41 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.493 1.117 . . . . 72.109999999999999 111.323 -174.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 88.6 mt -60.31 -47.52 92.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 CA-C-N 115.043 -0.981 . . . . 72.040000000000006 110.921 175.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -52.7 -48.82 66.33 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.597 0.759 . . . . 71.340000000000003 112.282 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -60.31 -50.49 73.43 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 116.186 -0.461 . . . . 73.540000000000006 111.329 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.482 HG13 HG23 ' A' ' 42' ' ' ILE . 54.6 t -55.87 -42.3 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 123.096 0.559 . . . . 62.450000000000003 112.153 179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -58.08 -43.95 87.29 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 123.231 0.612 . . . . 62.32 111.462 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 3.4 m-20 -65.93 -43.81 86.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.057 0.543 . . . . 62.329999999999998 112.459 176.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.47 ' O ' HG23 ' A' ' 29' ' ' VAL . 19.4 m-20 -62.9 -34.78 78.15 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.934 0.494 . . . . 72.430000000000007 111.494 176.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 64.0 mt -64.68 -37.16 79.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 C-N-CA 123.584 0.754 . . . . 73.329999999999998 110.643 174.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 24' ' ' ASP . 54.9 mtpt -60.11 -43.54 95.52 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.012 0.525 . . . . 70.439999999999998 111.019 174.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -28.82 68.89 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 123.311 0.644 . . . . 71.099999999999994 112.018 174.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.552 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 93.4 t -70.0 -43.93 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 122.652 0.381 . . . . 63.509999999999998 111.316 173.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 26' ' ' ILE . 42.3 mt-10 -55.96 -30.2 61.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-O 121.166 0.508 . . . . 64.219999999999999 111.609 -178.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -81.3 -52.59 7.14 Favored 'General case' 0 CA--C 1.56 1.362 0 CA-C-N 115.39 -0.823 . . . . 62.25 111.094 174.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -122.97 83.88 50.53 Favored Pre-proline 0 N--CA 1.498 1.96 0 C-N-CA 124.34 1.056 . . . . 61.409999999999997 110.352 -179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.463 ' HA ' HG13 ' A' ' 29' ' ' VAL . 21.9 Cg_exo -68.09 -33.01 26.47 Favored 'Trans proline' 0 C--N 1.387 2.583 0 C-N-CA 123.412 2.741 . . . . 54.219999999999999 114.723 -171.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -89.76 -2.73 58.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.675 0.79 . . . . 74.349999999999994 112.16 -171.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.34 98.23 3.79 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.769 0.795 . . . . 64.420000000000002 110.35 171.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.652 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 34.9 mmt -66.01 -16.49 63.95 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.481 -1.236 . . . . 75.230000000000004 112.972 -178.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.81 -45.4 78.28 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.748 0.819 . . . . 71.120000000000005 111.864 170.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -67.86 -46.4 71.85 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.732 0.813 . . . . 74.430000000000007 111.317 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.552 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 67.6 m95 -67.5 -27.49 67.05 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.152 0.797 . . . . 73.019999999999996 113.152 177.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -66.05 -41.71 90.45 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.072 0.549 . . . . 63.350000000000001 110.33 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.9 mmtt -57.96 -55.07 39.62 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.118 0.567 . . . . 74.510000000000005 110.728 174.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.482 HG23 HG13 ' A' ' 22' ' ' VAL . 96.9 mt -55.61 -49.47 73.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 124.551 1.14 . . . . 74.0 112.144 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -57.31 -45.54 84.08 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.081 0.952 . . . . 64.349999999999994 112.359 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -70.57 -37.35 73.96 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 122.904 0.482 . . . . 60.0 112.2 -178.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.426 ' O ' ' HG3' ' A' ' 49' ' ' MET . 92.5 mt -68.24 -42.03 80.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.621 0.368 . . . . 54.439999999999998 110.95 177.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.607 HG11 ' HB ' ' A' ' 68' ' ' ILE . 68.3 t -66.99 -33.04 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.752 0.821 . . . . 74.329999999999998 111.563 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -59.22 -43.67 92.32 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.225 0.61 . . . . 72.129999999999995 109.749 173.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 52' ' ' ILE . 85.0 m -67.41 -39.98 85.56 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.833 -0.621 . . . . 72.120000000000005 111.425 176.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 45' ' ' LEU . 54.9 mtt -58.95 -43.08 91.2 Favored 'General case' 0 N--CA 1.504 2.273 0 CA-C-O 121.313 0.578 . . . . 72.329999999999998 111.281 176.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -63.12 -46.19 88.47 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.827 -1.079 . . . . 50.140000000000001 110.35 176.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -59.64 -37.07 77.69 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.777 0.831 . . . . 73.349999999999994 112.015 177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 48' ' ' THR . 81.5 mt -59.35 -55.33 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 124.028 0.931 . . . . 72.310000000000002 110.913 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.532 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 4.2 t -69.42 -28.34 66.06 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.875 0.694 . . . . 74.400000000000006 112.875 179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -69.92 -42.65 73.05 Favored 'General case' 0 N--CA 1.496 1.862 0 C-N-CA 122.743 0.417 . . . . 73.340000000000003 111.813 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.1 t -71.7 -21.55 61.76 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.523 0.329 . . . . 72.439999999999998 111.101 177.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.3 mtt -75.25 -32.83 61.2 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.303 0.641 . . . . 60.140000000000001 110.915 167.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.86 -10.09 23.23 Favored Glycine 0 C--N 1.354 1.556 0 C-N-CA 123.235 0.445 . . . . 74.540000000000006 113.937 177.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.532 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.5 m-85 -74.96 96.36 3.15 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.659 0.784 . . . . 73.129999999999995 112.04 -175.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.8 m -73.71 -26.43 60.69 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.656 0.382 . . . . 74.420000000000002 111.303 173.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.7 m -63.35 -45.55 90.7 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.676 0.79 . . . . 54.340000000000003 111.969 178.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.415 ' HB ' ' OG1' ' A' ' 53' ' ' THR . 21.7 t -73.82 -44.57 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.348 0 CA-C-N 116.348 -0.387 . . . . 62.310000000000002 110.063 176.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -54.51 -32.03 57.22 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.852 0.861 . . . . 61.039999999999999 112.464 177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 67' ' ' THR . 87.8 tttt -57.92 -46.59 84.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.023 0.929 . . . . 64.209999999999994 111.992 175.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 44.4 t -61.45 -43.39 96.71 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 C-N-CA 123.355 0.662 . . . . 54.25 111.068 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.12 -28.29 61.27 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.312 0.645 . . . . 64.230000000000004 111.344 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -71.39 -29.37 64.86 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.836 0.854 . . . . 72.450000000000003 110.625 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' O ' ' A' ' 63' ' ' LYS . 44.8 p -70.35 -32.45 70.16 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-N 116.794 -0.184 . . . . 62.119999999999997 110.511 175.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.607 ' HB ' HG11 ' A' ' 46' ' ' VAL . 6.5 mm -75.25 -37.32 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 123.042 0.537 . . . . 74.319999999999993 110.249 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.411 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 76.8 mmm -53.19 -50.38 64.78 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 115.603 -0.726 . . . . 73.049999999999997 110.552 169.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -64.26 -40.76 96.65 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.151 0.98 . . . . 52.409999999999997 111.811 178.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 tt -64.63 -56.41 14.01 Favored 'General case' 0 CA--C 1.556 1.205 0 C-N-CA 124.718 1.207 . . . . 74.420000000000002 110.626 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 42.5 t -67.55 -31.02 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.82 0.848 . . . . 63.210000000000001 111.68 178.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 69' ' ' MET . 13.8 t70 -56.65 -39.25 73.36 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 123.49 0.716 . . . . 72.530000000000001 110.867 174.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.428 ' HB3' HG13 ' A' ' 80' ' ' ILE . 94.7 mttt -69.08 -30.82 69.21 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.665 0.786 . . . . 64.299999999999997 112.606 176.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.422 ' HE2' HG23 ' A' ' 82' ' ' ILE . 42.0 mtt -68.89 -35.37 76.8 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.083 0.553 . . . . 61.119999999999997 112.152 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.652 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 9.7 mp -56.33 -35.02 67.11 Favored 'General case' 0 N--CA 1.495 1.789 0 C-N-CA 123.635 0.774 . . . . 61.310000000000002 112.625 176.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -94.87 131.99 40.17 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.655 0.74 . . . . 72.230000000000004 110.691 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.0 t -76.04 3.91 9.45 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.451 1.1 . . . . 74.409999999999997 112.824 -173.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.66 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.4 pt-20 -75.26 -29.75 60.27 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.245 0.618 . . . . 63.130000000000003 111.369 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.66 HG12 ' HG3' ' A' ' 79' ' ' GLU . 25.0 mm -92.27 -39.95 11.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 124.221 1.008 . . . . 62.340000000000003 112.449 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt 74.2 140.4 0.06 Allowed 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 124.941 1.296 . . . . 75.310000000000002 112.172 -177.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 75' ' ' MET . 3.8 mp -91.58 97.51 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 123.309 0.644 . . . . 55.420000000000002 109.52 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.404 ' O ' HG13 ' A' ' 87' ' ' ILE . 90.9 m -82.22 137.85 34.79 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.86 -0.609 . . . . 63.229999999999997 110.84 177.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.52 ' HA ' HD12 ' A' ' 87' ' ' ILE . 78.8 p -57.43 -43.37 83.8 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.644 0.777 . . . . 42.520000000000003 112.398 179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.35 -32.38 73.97 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.8 0.84 . . . . 72.450000000000003 111.818 177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.639 HD12 ' HD2' ' A' ' 89' ' ' LYS . 34.2 tp -70.4 -34.37 72.46 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.689 -0.687 . . . . 64.299999999999997 110.903 175.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.52 HD12 ' HA ' ' A' ' 84' ' ' SER . 56.8 mt -62.34 -33.53 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 123.198 0.599 . . . . 61.109999999999999 110.103 171.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -69.33 -27.02 65.0 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.119 0.568 . . . . 54.210000000000001 111.179 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.639 ' HD2' HD12 ' A' ' 86' ' ' LEU . 65.9 mttm -65.22 -43.35 91.77 Favored 'General case' 0 N--CA 1.478 0.954 0 O-C-N 123.173 0.295 . . . . 74.030000000000001 110.586 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.3 t -60.42 -38.28 77.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.882 0.873 . . . . 73.219999999999999 111.243 178.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.62 -51.22 69.41 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.623 0.769 . . . . 75.040000000000006 112.333 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -69.7 -31.38 69.38 Favored 'General case' 0 CA--C 1.558 1.255 0 N-CA-C 112.269 0.47 . . . . 74.040000000000006 112.269 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -63.4 -45.09 92.64 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.464 0.912 . . . . 72.329999999999998 113.464 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 95' ' ' ASP . 4.1 pp -70.68 -30.31 66.86 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-O 121.094 0.474 . . . . 71.340000000000003 111.15 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.485 ' N ' HD12 ' A' ' 94' ' ' LEU . 20.8 m-20 -61.84 -44.96 95.79 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 115.63 -0.714 . . . . 74.129999999999995 110.065 171.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 20.3 ttt -57.7 -35.56 70.79 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.631 1.172 . . . . 43.119999999999997 112.192 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 86.5 t -62.22 -46.93 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 123.415 0.686 . . . . 74.120000000000005 111.179 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 50.3 m -65.56 -45.67 82.44 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.2 0.6 . . . . 71.109999999999999 111.472 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -70.37 -26.15 63.59 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.411 1.085 . . . . 75.409999999999997 112.433 -176.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.24 -46.83 78.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.846 0.458 . . . . 61.43 110.633 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 46.5 tp -67.24 -39.12 86.15 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.396 0.678 . . . . 73.450000000000003 110.947 176.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -59.32 -37.92 78.99 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.949 0.9 . . . . 70.109999999999999 111.051 172.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -77.27 -19.88 55.88 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 71.150000000000006 111.459 179.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -79.31 -29.94 42.62 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.892 0.477 . . . . 73.450000000000003 111.699 172.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.5 t -89.6 -65.74 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.115 0.566 . . . . 71.549999999999997 111.006 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.1 t -69.54 -25.9 64.24 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 124.306 1.042 . . . . 61.340000000000003 112.786 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.32 74.1 2.11 Favored Glycine 0 N--CA 1.476 1.303 0 N-CA-C 114.624 0.61 . . . . 51.409999999999997 114.624 -176.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 31.6 t -126.46 89.39 3.0 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.96 0.904 . . . . 64.099999999999994 108.79 172.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -134.65 176.78 8.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.873 0.869 . . . . 75.319999999999993 110.982 -173.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 57.2 63.06 1.99 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.664 1.185 . . . . 72.329999999999998 111.802 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 22.5 m -111.88 142.52 26.87 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 123.237 0.615 . . . . 71.340000000000003 112.142 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -74.16 154.14 46.67 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 123.24 2.626 . . . . 75.140000000000001 112.61 170.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.565 1.54 0 C-N-CA 123.164 0.586 . . . . 64.430000000000007 109.626 177.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.439 0.161 . . . . 75.099999999999994 111.072 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.91 99.53 0.18 Allowed Glycine 0 C--N 1.348 1.238 0 N-CA-C 113.815 0.286 . . . . 72.010000000000005 113.815 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.9 m -128.33 29.98 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.362 1.065 . . . . 72.420000000000002 109.943 171.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -62.46 -45.86 91.15 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.709 0.804 . . . . 74.219999999999999 111.175 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 75.7 mt-30 -58.78 -50.87 72.33 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.276 0.63 . . . . 72.140000000000001 111.078 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.437 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 40.8 tt0 -52.21 -50.73 61.36 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.766 0.826 . . . . 64.439999999999998 111.656 177.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -53.84 -50.49 66.09 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.154 0.982 . . . . 75.510000000000005 111.496 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 85.0 mt -63.77 -38.96 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.591 0.756 . . . . 73.219999999999999 111.863 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 5' ' ' GLN . 63.4 mttm -64.08 -39.06 93.24 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 123.112 0.565 . . . . 70.219999999999999 111.885 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 5.2 mptp? -64.4 -49.73 70.4 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.924 0.49 . . . . 71.510000000000005 110.494 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 90.9 t -58.75 -30.79 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 C-N-CA 123.933 0.893 . . . . 62.450000000000003 111.835 176.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 15' ' ' LEU . 88.6 m -65.13 -45.7 83.99 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.347 0.659 . . . . 73.519999999999996 110.808 174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.601 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 55.1 m-20 -70.31 -29.99 66.85 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.894 0.331 . . . . 54.210000000000001 111.894 176.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 14.1 mm-40 -66.45 -28.71 68.81 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.022 0.529 . . . . 74.409999999999997 110.914 172.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' A' ' 12' ' ' THR . 6.4 tt -68.49 -38.2 80.77 Favored 'General case' 0 CA--C 1.559 1.293 0 C-N-CA 123.981 0.912 . . . . 55.439999999999998 111.138 173.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.601 ' HE3' ' HA ' ' A' ' 13' ' ' ASP . 0.0 OUTLIER -69.91 -39.34 76.24 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.873 -0.517 . . . . 54.25 111.345 172.547 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -58.6 -30.4 67.19 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 123.729 0.812 . . . . 73.319999999999993 111.385 171.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD21 ' HB ' ' A' ' 48' ' ' THR . 5.2 tp -76.27 -46.39 28.2 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 114.635 -1.166 . . . . 74.519999999999996 110.86 179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 91.7 mt -60.5 -49.32 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.461 0.704 . . . . 74.219999999999999 111.781 178.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -63.15 -36.63 84.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.614 0.366 . . . . 71.129999999999995 111.36 -177.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -52.19 17.15 Favored 'General case' 0 CA--C 1.548 0.893 0 CA-C-N 115.718 -0.673 . . . . 75.120000000000005 109.611 -177.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.52 HG13 HG23 ' A' ' 42' ' ' ILE . 62.0 t -57.22 -43.17 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 C-N-CA 123.686 0.794 . . . . 72.019999999999996 111.364 176.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 12.4 t-20 -64.1 -40.7 96.78 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.532 0.733 . . . . 54.530000000000001 110.806 -177.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -68.83 -41.09 79.01 Favored 'General case' 0 CA--C 1.557 1.241 0 C-N-CA 123.542 0.737 . . . . 73.219999999999999 111.214 176.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.449 ' O ' HG23 ' A' ' 29' ' ' VAL . 1.0 OUTLIER -65.51 -34.85 79.22 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.461 0.705 . . . . 75.150000000000006 112.174 176.039 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 22' ' ' VAL . 93.1 mt -67.87 -34.32 66.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 110.171 -0.307 . . . . 74.409999999999997 110.171 175.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' A' ' 23' ' ' ASN . 61.7 mttp -64.03 -38.2 90.22 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 122.812 0.445 . . . . 65.510000000000005 110.626 172.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.7 mm-40 -64.87 -25.81 68.05 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.269 0.627 . . . . 64.420000000000002 111.831 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.525 HG11 ' CZ2' ' A' ' 39' ' ' TRP . 18.9 t -80.17 -35.61 15.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 CA-C-O 120.77 0.319 . . . . 62.219999999999999 111.696 170.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.84 -26.21 65.63 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.79 0.805 . . . . 74.420000000000002 109.872 171.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -80.79 -51.66 8.38 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 125.35 1.46 . . . . 70.540000000000006 111.111 173.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.402 ' HB2' ' HE2' ' A' ' 38' ' ' TYR . 17.1 m120 -129.18 91.32 42.41 Favored Pre-proline 0 N--CA 1.495 1.818 0 C-N-CA 124.438 1.095 . . . . 60.329999999999998 110.161 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -60.99 -50.13 6.86 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 123.178 2.585 . . . . 63.140000000000001 115.3 -168.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -96.53 9.25 42.01 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.999 0.74 . . . . 71.450000000000003 112.999 -169.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.57 100.7 3.98 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 121.817 0.817 . . . . 74.109999999999999 110.402 170.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.574 ' SD ' ' HA ' ' A' ' 76' ' ' LEU . 10.0 mmt -67.74 -25.3 65.57 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 114.387 -1.279 . . . . 64.340000000000003 112.744 -173.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.46 -40.77 68.74 Favored 'General case' 0 CA--C 1.558 1.277 0 C-N-CA 123.91 0.884 . . . . 64.439999999999998 112.127 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.402 ' HE2' ' HB2' ' A' ' 32' ' ' ASN . 33.6 m-85 -63.77 -44.91 92.02 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.268 0.627 . . . . 72.420000000000002 111.124 173.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.525 ' CZ2' HG11 ' A' ' 29' ' ' VAL . 69.4 m95 -68.86 -27.55 65.92 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.189 0.811 . . . . 72.129999999999995 113.189 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -64.91 -44.57 89.14 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.098 0.475 . . . . 71.420000000000002 110.105 174.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 75.5 mmtt -56.61 -56.34 22.62 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 114.875 -1.057 . . . . 74.439999999999998 110.811 173.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.52 HG23 HG13 ' A' ' 22' ' ' VAL . 93.6 mt -59.34 -41.75 85.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.059 0.944 . . . . 74.099999999999994 111.874 -177.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -62.65 -47.11 85.12 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 75.430000000000007 111.168 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -73.62 -27.27 61.19 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 113.334 0.865 . . . . 73.310000000000002 113.334 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 41' ' ' LYS . 94.3 mt -74.32 -36.64 63.71 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 122.409 0.284 . . . . 64.109999999999999 110.963 173.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 68' ' ' ILE . 69.1 t -74.51 -27.28 20.95 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.494 0.718 . . . . 72.319999999999993 110.272 173.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 53.0 t-80 -65.72 -30.02 70.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.317 0.647 . . . . 62.219999999999999 110.206 168.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 51' ' ' GLU . 37.9 m -74.14 -39.47 63.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.352 0.261 . . . . 73.420000000000002 110.654 172.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.416 ' O ' HG22 ' A' ' 53' ' ' THR . 65.5 mtt -60.02 -39.74 86.87 Favored 'General case' 0 N--CA 1.499 1.995 0 CA-C-O 121.179 0.514 . . . . 74.230000000000004 110.601 173.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -56.86 -56.4 22.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.403 1.481 . . . . 74.409999999999997 111.382 174.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 48' ' ' THR . 12.7 pt-20 -66.54 -31.79 72.73 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 111.834 0.309 . . . . 61.039999999999999 111.834 -177.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 61.3 mt -60.94 -56.21 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 C-N-CA 123.427 0.691 . . . . 72.209999999999994 110.786 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.5 ' OG1' ' HB2' ' A' ' 58' ' ' PHE . 7.9 t -69.25 -33.11 72.76 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.751 0.648 . . . . 61.229999999999997 112.751 -178.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -76.66 -30.87 56.99 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 112.433 0.531 . . . . 73.319999999999993 112.433 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.1 t -74.39 -22.1 59.33 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-N 118.177 0.444 . . . . 53.25 111.004 173.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 67.1 mtt -80.63 -29.3 36.76 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.501 0.721 . . . . 73.150000000000006 110.847 169.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 105.67 6.17 38.29 Favored Glycine 0 C--N 1.353 1.501 0 N-CA-C 114.38 0.512 . . . . 41.520000000000003 114.38 175.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.5 ' HB2' ' OG1' ' A' ' 53' ' ' THR . 91.4 m-85 -81.27 88.06 6.09 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 123.336 0.654 . . . . 75.209999999999994 111.205 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 69.9 m -71.45 -25.06 62.14 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.017 0.527 . . . . 75.329999999999998 111.732 176.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 61.6 m -69.85 -43.67 71.43 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.763 0.825 . . . . 64.329999999999998 111.716 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.44 -42.15 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 109.899 -0.408 . . . . 64.230000000000004 109.899 175.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.59 -33.12 71.05 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.36 0.664 . . . . 60.149999999999999 112.129 175.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.82 -37.72 87.9 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.237 1.015 . . . . 65.219999999999999 111.348 176.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.27 -47.91 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.334 0.653 . . . . 51.409999999999997 110.748 175.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.489 ' HA ' HD13 ' A' ' 68' ' ' ILE . 4.1 mm? -68.03 -27.68 66.74 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.237 0.615 . . . . 74.239999999999995 111.87 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -64.93 -26.44 68.31 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 124.13 0.972 . . . . 72.120000000000005 111.084 176.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.7 p -65.71 -40.31 92.1 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 117.409 0.095 . . . . 73.140000000000001 110.776 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.556 HD11 ' HB3' ' A' ' 93' ' ' LYS . 4.2 mp -64.7 -43.51 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.16 0.584 . . . . 73.400000000000006 109.997 175.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 80.8 mmm -58.27 -39.23 78.7 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.424 0.69 . . . . 64.25 111.444 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -74.31 -34.66 63.55 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.11 0.964 . . . . 71.120000000000005 110.849 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.452 HD21 ' HG ' ' A' ' 86' ' ' LEU . 5.5 tt -74.23 -57.68 3.79 Favored 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.53 1.132 . . . . 71.209999999999994 110.889 -175.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 59.1 t -61.81 -31.87 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 124.665 1.186 . . . . 70.010000000000005 112.381 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.33 -36.91 71.73 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.548 0.739 . . . . 54.409999999999997 111.534 174.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' ILE . 62.7 mttp -68.39 -36.99 79.95 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.6 0.76 . . . . 74.239999999999995 112.039 174.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 41.8 mtt -64.01 -42.13 97.24 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.114 0.566 . . . . 71.299999999999997 111.617 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.574 ' HA ' ' SD ' ' A' ' 36' ' ' MET . 6.4 mp -51.94 -35.61 46.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.545 1.138 . . . . 70.109999999999999 113.043 -179.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -97.99 127.66 44.07 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 121.374 0.607 . . . . 35.420000000000002 110.968 173.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.8 t -71.14 -0.26 9.28 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.584 1.154 . . . . 34.009999999999998 113.162 -173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.713 ' HG3' HG12 ' A' ' 80' ' ' ILE . 12.0 pt-20 -68.05 -29.06 67.94 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.715 0.806 . . . . 71.239999999999995 111.374 176.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.713 HG12 ' HG3' ' A' ' 79' ' ' GLU . 19.9 mm -94.95 -38.7 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.473 1.109 . . . . 63.210000000000001 110.512 -177.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 64.36 165.79 0.15 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 125.114 1.366 . . . . 74.150000000000006 112.212 -171.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.455 HD11 ' HE1' ' A' ' 36' ' ' MET . 3.3 mp -106.36 101.94 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 CA-C-N 116.094 -0.503 . . . . 74.430000000000007 110.134 -174.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.491 ' HB ' ' HB2' ' A' ' 86' ' ' LEU . 86.6 m -70.09 140.9 52.8 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.705 -0.68 . . . . 62.329999999999998 110.38 175.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.8 t -54.72 -56.74 15.97 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.587 0.755 . . . . 62.109999999999999 111.724 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -65.93 -19.51 65.89 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 113.189 0.811 . . . . 75.109999999999999 113.189 178.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.491 ' HB2' ' HB ' ' A' ' 83' ' ' THR . 26.5 tp -71.51 -34.63 70.27 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 121.944 -0.473 . . . . 63.299999999999997 110.82 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.427 HD13 HG12 ' A' ' 29' ' ' VAL . 43.0 mt -61.06 -35.67 67.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.447 0.641 . . . . 70.329999999999998 109.892 171.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -69.93 -27.9 65.14 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 115.136 -0.938 . . . . 72.219999999999999 111.129 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.476 ' HD2' HD12 ' A' ' 86' ' ' LEU . 56.5 mttp -68.41 -41.73 80.02 Favored 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.244 0.34 . . . . 73.329999999999998 110.905 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.52 -45.33 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 CA-C-O 121.924 0.868 . . . . 70.409999999999997 110.479 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -61.34 -39.77 91.78 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 113.913 -1.494 . . . . 70.519999999999996 110.655 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -69.6 -39.38 77.27 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.143 0.977 . . . . 74.400000000000006 112.53 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.556 ' HB3' HD11 ' A' ' 68' ' ' ILE . 75.1 mmtt -56.41 -40.33 74.52 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.247 0.619 . . . . 62.149999999999999 111.855 173.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 46.5 tp -75.21 -38.58 60.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.851 0.46 . . . . 65.349999999999994 111.372 177.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.13 -32.92 68.61 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.141 0.577 . . . . 64.209999999999994 111.184 170.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' MET . . . . . . . . . . . . . 36.3 ttm -68.05 -38.6 82.67 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.22 1.008 . . . . 71.310000000000002 111.347 176.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 101' ' ' LEU . 60.2 t -62.6 -49.62 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 123.003 0.521 . . . . 64.420000000000002 110.475 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.0 m -64.22 -42.72 96.46 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.701 0.8 . . . . 72.25 111.91 -179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 32.9 mtm180 -71.16 -27.35 63.49 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.256 0.623 . . . . 74.420000000000002 111.961 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -65.84 -45.86 80.65 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 109.798 -0.445 . . . . 75.030000000000001 109.798 171.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 97' ' ' VAL . 83.1 mt -59.03 -35.51 73.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.573 0.749 . . . . 62.240000000000002 111.12 174.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -44.27 92.63 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.669 0.787 . . . . 72.340000000000003 111.378 176.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -65.95 -34.44 78.13 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.004 0.521 . . . . 62.020000000000003 111.752 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -81.9 -36.99 27.52 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.148 0.579 . . . . 74.129999999999995 112.409 -177.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.8 -22.28 24.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.736 -0.602 . . . . 71.450000000000003 110.445 176.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -70.64 -29.25 65.56 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.785 0.834 . . . . 72.329999999999998 111.762 172.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 176.15 80.27 0.05 OUTLIER Glycine 0 C--N 1.355 1.626 0 N-CA-C 114.212 0.445 . . . . 74.099999999999994 114.212 178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 70.9 p -107.41 155.82 19.61 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.79 0.836 . . . . 73.140000000000001 111.002 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -147.33 125.96 12.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.554 0.742 . . . . 74.530000000000001 110.701 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 82.9 mt -96.56 119.39 34.96 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.427 0.691 . . . . 44.240000000000002 110.941 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 31.6 m -88.1 158.43 49.79 Favored Pre-proline 0 CA--C 1.565 1.544 0 C-N-CA 123.683 0.793 . . . . 73.099999999999994 110.728 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -61.57 -38.01 65.52 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 122.408 2.072 . . . . 51.530000000000001 113.491 -178.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.5 mpt_? . . . . . 0 N--CA 1.49 1.565 0 C-N-CA 123.35 0.66 . . . . 71.409999999999997 109.938 174.347 . . . . . . . . 0 0 . 1 stop_ save_